SCHEMBL445148

SCHEMBL445148

CC1(C)Oc2ccc(N)cc2NC1=O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
PDE3B Q13370 2/20 0.50
PDE3A Q14432 2/20 0.50
POLB P06746 2/20 0.49
HPGD P15428 1/20 0.49
NPC1 O15118 1/20 0.44
BRD4 O60885 9/20 0.41
JAK1 P23458 1/20 0.40
JAK3 P52333 1/20 0.40
CYP19A1 P11511 1/20 0.39
SYK P43405 2/20 0.38
CA9 Q16790 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30343148 1.00 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL755992 0.86 BRD4 (0.50) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL89103 0.81 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL295046 0.79 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL3596598 0.79 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL19527524 0.79 KDM4E (0.38) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL656665 0.79 JAK1 (0.40) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL8256073 0.79 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL1634782 0.79 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A
SCHEMBL30024800 0.79 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2PDE3BPDE3A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 177 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050153960-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2005-07-14 US claimed
CN-113929618-B Oxo-pyridine amide derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2023-08-11 CN disclosed
CN-113912586-B Oxopyridine amide derivatives, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2023-04-07 CN disclosed
CN-113929618-A Oxopyridine amide derivatives, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2022-01-14 CN disclosed
CN-113912586-A Oxopyridine amide derivatives, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2022-01-11 CN disclosed
EP-3486242-B1 OXOPICOLINAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF JIANGSU HENGRUI MEDICINE CO (CN) 2021-12-08 EP disclosed
CN-108495850-B Oxopyridine amide derivatives, preparation method thereof and application thereof in medicines 江苏恒瑞医药股份有限公司 2021-11-26 CN disclosed
US-11084808-B2 Oxopicolinamide derivative, preparation method therefor and pharmaceutical use thereof JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2021-08-10 US disclosed
US-11007193-B2 2,4-pyrimidinediamine compounds and their uses RIGEL PHARMACEUTICALS, INC. (US) 2021-05-18 US disclosed
US-10828301-B2 2,4-pyrimidinediamine compounds and their uses Rigel Pharmceuticals, Inc. (US) 2020-11-10 US disclosed
US-20040204437-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2004-10-14 US disclosed
US-20040087568-A1 Substituted anthranilic amide derivatives and methods of use AMGEN INC. 2004-05-06 US disclosed
US-20040029902-A1 Antiinflamamtory agents MIDCAP FINANCIAL TRUST 2004-02-12 US disclosed
US-20030225106-A1 Substituted alkylamine derivatives and methods of use AMGEN INC. 2003-12-04 US disclosed
US-20030203922-A1 Substituted amine derivatives and methods of use AMGEN INC. 2003-10-30 US disclosed
US-20030195230-A1 Substituted amine derivatives and methods of use AMGEN INC. 2003-10-16 US disclosed
WO-2003063794-A2 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES RIGEL PHARMACEUTICALS, INC. (US) 2003-08-07 WO disclosed
US-20030134836-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2003-07-17 US disclosed
US-20030125339-A1 Substituted alkylamine derivatives and methods of use AMGEN INC. 2003-07-03 US disclosed
US-20020147198-A1 Substituted arylamine derivatives and methods of use AMGEN INC. 2002-10-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (13 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050153960-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR KDM4E 1056/4885ALDH1A1 178/4885SMN1; SMN2 2424/4885
US-20030225106-A1 Substituted alkylamine derivatives and methods of use NAT1, PIGO, AADAC KDM4E 922/4885ALDH1A1 389/4885SMN1; SMN2 1447/4885
US-20040204437-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR KDM4E 1056/4885ALDH1A1 178/4885SMN1; SMN2 2424/4885
US-20040029902-A1 Antiinflamamtory agents FCER2, FCGR1A, HNMT KDM4E 2664/4885ALDH1A1 2723/4885SMN1; SMN2 4738/4885
US-20030125339-A1 Substituted alkylamine derivatives and methods of use AADAC, NAT1, PIGO KDM4E 1133/4885ALDH1A1 261/4885SMN1; SMN2 2090/4885
US-20030134836-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR KDM4E 1056/4885ALDH1A1 178/4885SMN1; SMN2 2424/4885
US-20030203922-A1 Substituted amine derivatives and methods of use MAOB, HNMT, FLT4 KDM4E 850/4885ALDH1A1 192/4885SMN1; SMN2 1788/4885
US-20040087568-A1 Substituted anthranilic amide derivatives and methods of use AADAC, ASPH, EGLN3 KDM4E 1794/4885ALDH1A1 540/4885SMN1; SMN2 3639/4885
US-11007193-B2 2,4-pyrimidinediamine compounds and their uses FCER2, FCGR1A, FCGR2A KDM4E 2840/4885ALDH1A1 2891/4885SMN1; SMN2 4764/4885
US-20020147198-A1 Substituted arylamine derivatives and methods of use NAT1, AADAC, AHR KDM4E 1056/4885ALDH1A1 178/4885SMN1; SMN2 2424/4885
US-10828301-B2 2,4-pyrimidinediamine compounds and their uses FCER2, FCGR1A, FCGR2A KDM4E 2840/4885ALDH1A1 2891/4885SMN1; SMN2 4764/4885
US-20030195230-A1 Substituted amine derivatives and methods of use MAOB, HNMT, FLT4 KDM4E 850/4885ALDH1A1 192/4885SMN1; SMN2 1788/4885
US-11084808-B2 Oxopicolinamide derivative, preparation method therefor and pharmaceutical use thereof F11, F2, F7 KDM4E 3441/4885ALDH1A1 3297/4885SMN1; SMN2 4489/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.