SCHEMBL2472811

SCHEMBL2472811

CC(=O)Oc1c(Cl)cc(C(C)(C)CC(C)(C)C)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.37
CYP3A4 P08684 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
ESR1 P03372 1/20 0.36
TP53 P04637 1/20 0.36
PGR P06401 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
AR P10275 1/20 0.36
MAPT P10636 1/20 0.36
DRD1 P21728 1/20 0.36
PTGS1 P23219 1/20 0.36
SLC6A2 P23975 1/20 0.36
PDE4A P27815 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP1 P29466 1/20 0.36
SLC6A4 P31645 1/20 0.36
OPRM1 P35372 1/20 0.36

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
SCHEMBL2472809 0.84 SHBG (0.35) SHBGCYP3A4SMN1; SMN2MEN1KMT2A
SCHEMBL10882790 0.81 ABCB11 (0.40) CYP3A4SMN1; SMN2MEN1KMT2ATP53
SCHEMBL28165578 0.80 ALDH1A1 (0.34) SHBGCYP3A4SMN1; SMN2MEN1KMT2A
SCHEMBL152840 0.78 CYP2C19 (0.51) SMN1; SMN2KMT2ACYP2C19KDM4ETDP1
SCHEMBL28211718 0.76 ALDH1A1 (0.45) SMN1; SMN2KMT2AUSP2MAPTMAPK1
SCHEMBL9070169 0.73 SHBG (0.50) SHBGCYP3A4SMN1; SMN2MEN1KMT2A
SCHEMBL1269005 0.73 CYP3A4 (0.33) SHBGCYP3A4SMN1; SMN2MEN1KMT2A
SCHEMBL4645395 0.73 ABCB11 (0.49) CYP3A4SMN1; SMN2MEN1KMT2ATP53
SCHEMBL7620007 0.71 CYP3A4 (0.56) SHBGCYP3A4SMN1; SMN2MEN1KMT2A
SCHEMBL5688964 0.71 LMNA (0.43) MEN1KMT2ATP53MAPTABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104530417-B A kind of multiple functionalized H types polyethyleneglycol derivative and preparation method thereof 厦门赛诺邦格生物科技股份有限公司 2017-09-08 CN claimed
CN-104530415-B A kind of different functionalization Y types polyethyleneglycol derivative, preparation method and its bio-related substance 厦门赛诺邦格生物科技股份有限公司 2017-09-01 CN claimed
US-20240376133-A9 CROSSLINKING COMONOMERS FOR HIGH PERFORMANCE DEGRADABLE THERMOSETS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2024-11-14 US disclosed
EP-3257887-B1 POLYCARBONATE POLYOL COMPOSITIONS AND METHODS SAUDI ARAMCO TECH CO (SA) 2024-11-06 EP disclosed
EP-4323340-A2 E3 LIGASE BINDERS AND USES THEREOF President and Fellows of Harvard College (US) 2024-02-21 EP disclosed
US-11878019-B2 Uses of pyrimidopyrimidinones as SIK inhibitors THE GENERAL HOSPITAL CORPORATION (US) 2024-01-23 US disclosed
US-20230416283-A1 CROSSLINKING COMONOMERS FOR HIGH PERFORMANCE DEGRADABLE THERMOSETS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-12-28 US disclosed
US-20220175934-A1 MULTIVALENT LIGAND CLUSTERS FOR TARGETED DELIVERY OF THERAPEUTIC AGENTS MITOTHERAPEUTIX LLC 2022-06-09 US disclosed
EP-4003062-A1 SYNTHESIS OF PRO-RESOLVING ANALOGS AND COMPOSITIONS THEREFOR Nocendra Inc. (US) 2022-06-01 EP disclosed
CN-108588151-B Process for large scale enzymatic synthesis of oligosaccharides 台湾地区“中央研究院” 2022-05-13 CN disclosed
US-20220133736-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS THE GENERAL HOSPITAL CORPORATION (US) 2022-05-05 US disclosed
US-20120158026-A1 GASTROINTESTINAL IMPLANT DEVICE VYSERA BIOMEDICAL LIMITED (IE) 2012-06-21 US disclosed
EP-2370436-A1 AZAQUINOLINONE DERIVATIVES AND USES THEREOF Link Medicine Corporation (US) 2011-10-05 EP disclosed
CN-102014897-A Compounds, compositions and methods for making the same SIGNUM BIOSCIENCES INC 2011-04-13 CN disclosed
WO-2010057006-A9 AZAQUINOLINONE DERIVATIVES AND USES THEREOF LINK MEDICINE CORPORATION (US) 2010-09-16 WO disclosed
WO-2010057006-A1 AZAQUINOLINONE DERIVATIVES AND USES THEREOF LINK MEDICINE CORPORATION (US) 2010-05-20 WO disclosed
US-20060166278-A1 Method for synthesizing sugar chain(s) MITSUBISHI CHEMICAL CORPORATION (JP) 2006-07-27 US disclosed
EP-1640379-A1 METHOD OF SYNTHESIZING SUGAR CHAIN Mitsubishi Chemical Corporation (JP) 2006-03-29 EP disclosed
EP-0938475-A1 PIPERIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 1999-09-01 EP disclosed
WO-1998017647-A1 PIPERIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 1998-04-30 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 (5 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-20240376133-A9 CROSSLINKING COMONOMERS FOR HIGH PERFORMANCE DEGRADABLE THERMOSETS PGD, CDCA2, MCM2 SHBG 4265/4885CYP3A4 269/4885SMN1; SMN2 456/4885
US-20220133736-A1 USES OF PYRIMIDOPYRIMIDINONES AS SIK INHIBITORS SIK2, SIK1, SIK3 SHBG 4579/4885CYP3A4 3080/4885SMN1; SMN2 3859/4885
US-20220175934-A1 MULTIVALENT LIGAND CLUSTERS FOR TARGETED DELIVERY OF THERAPEUTIC AGENTS ATIC, PCNA, FOLR1 SHBG 803/4885CYP3A4 4412/4885SMN1; SMN2 3044/4885
US-11878019-B2 Uses of pyrimidopyrimidinones as SIK inhibitors SIK2, SIK1, SIK3 SHBG 4579/4885CYP3A4 3080/4885SMN1; SMN2 3859/4885
US-20230416283-A1 CROSSLINKING COMONOMERS FOR HIGH PERFORMANCE DEGRADABLE THERMOSETS PGD, CDCA2, MCM2 SHBG 4265/4885CYP3A4 269/4885SMN1; SMN2 456/4885

“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.