SCHEMBL8355113

SCHEMBL8355113

Cn1cc(C(=O)O)c2cc(Cl)ccc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.63
MEN1 O00255 2/20 0.53
KDM4E B2RXH2 1/20 0.51
CDK2 P24941 1/20 0.48
NR4A2 P43354 2/20 0.47
F7 P08709 1/20 0.46
F3 P13726 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KCNH2 Q12809 1/20 0.46
POLB P06746 2/20 0.44
CYP2C9 P11712 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
MAOB P27338 1/20 0.44
MYC P01106 2/20 0.44

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
SCHEMBL9572754 0.87 KCNH2 (0.59) KMT2AMEN1KDM4ENR4A2ALDH1A1
SCHEMBL10258241 0.87 KMT2A (0.52) KMT2AMEN1KDM4ECDK2F7
SCHEMBL13114466 0.85 KDM4E (0.64) KMT2AMEN1KDM4ECDK2NR4A2
SCHEMBL4419843 0.84 KMT2A (0.50) KMT2AMEN1KDM4ECDK2NR4A2
SCHEMBL30622587 0.83 KMT2A (0.56) KMT2AMEN1KDM4ECDK2NR4A2
SCHEMBL12167181 0.83 KMT2A (0.56) KMT2AMEN1KDM4ECDK2NR4A2
SCHEMBL8356629 0.83 NR4A2 (0.64) KMT2AMEN1KDM4ENR4A2ALDH1A1
SCHEMBL13415460 0.83 GFER (0.52) KMT2AMEN1KDM4ENR4A2ALDH1A1
SCHEMBL13415459 0.83 NR4A2 (0.64) KMT2AKDM4ENR4A2KCNH2MAOB
SCHEMBL14115041 0.83 KMT2A (0.49) KMT2AKDM4ECDK2NR4A2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023277630-A1 GALACTOSIDE DERIVATIVE AS GALECTIN-3 INHIBITOR 주식회사 티움바이오 2023-01-05 WO disclosed
CN-104936950-B The carboxamide derivative of 1H indoles 3 and its purposes as P2Y12 antagonists 赛诺菲 2017-08-08 CN disclosed
US-9522140-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2016-12-20 US disclosed
US-9101616-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2015-08-11 US disclosed
US-9101616-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2015-08-11 US disclosed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
EP-2061759-B1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL MYERS SQUIBB CO (US) 2013-03-27 EP disclosed
US-8324251-B2 Cyclic modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2012-12-04 US disclosed
US-8324251-B2 Cyclic modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2012-12-04 US disclosed
US-20100093798-A1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2010-04-15 US disclosed
US-20100075963-A1 Pharmaceutically Active Benzensulphonyl-Indols NOVARTIS AG (CH) 2010-03-25 US disclosed
US-20100075963-A1 Pharmaceutically Active Benzensulphonyl-Indols NOVARTIS AG (CH) 2010-03-25 US disclosed
WO-2008095908-A1 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY NOVARTIS AG (CH) 2008-08-14 WO disclosed
WO-2008042926-A1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2008-04-10 WO disclosed
US-5877202-A Indole derivatives useful to treat estrogen-related neoplasms and disorders AVENTISUB II INC. 1999-03-02 US disclosed
EP-0746544-B1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMA INC (US) 1998-09-09 EP disclosed
CN-1141627-A Indole derivatives for the treatment of estrogen-related tumors and diseases MERRELL DOW PHARMA (US) 1997-01-29 CN disclosed
EP-0746544-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1996-12-11 EP disclosed
WO-1995022524-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1995-08-24 WO 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 (2 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-20100093798-A1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY CCR1, CXCR1, CCR3 KMT2A 4249/4885MEN1 3535/4885KDM4E 4223/4885
US-20100075963-A1 Pharmaceutically Active Benzensulphonyl-Indols CCR9, IDO1, CCR10 KMT2A 3255/4885MEN1 4615/4885KDM4E 1044/4885

“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.