SCHEMBL3500203

SCHEMBL3500203

COC(=O)C(Cc1ccc(OCc2ccc(C)cc2)cc1)NC(=O)c1cn2ccc(-c3ccc(Cl)cc3)cc2n1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 7/20 0.50
GPR34 Q9UPC5 3/20 0.45
PTPN1 P18031 1/20 0.41
FFAR1 O14842 2/20 0.40
ALOX5 P09917 1/20 0.39
ALOX5AP P20292 1/20 0.39
PPARG P37231 1/20 0.39
SMPD1 P17405 1/20 0.39
YAP1 P46937 2/20 0.38
BCL2 P10415 1/20 0.38
LMNA P02545 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
SCHEMBL3500205 1.00 CDK2 (0.50) CDK2GPR34PTPN1FFAR1ALOX5
SCHEMBL3497042 0.97 CDK2 (0.53) CDK2GPR34PTPN1PPARGSMPD1
SCHEMBL3497044 0.97 CDK2 (0.53) CDK2GPR34PTPN1PPARGSMPD1
SCHEMBL3497026 0.94 GPR34 (0.53) CDK2GPR34PTPN1PPARGYAP1
SCHEMBL3499627 0.94 CDK2 (0.50) CDK2GPR34PTPN1FFAR1PPARG
SCHEMBL3499625 0.94 CDK2 (0.50) CDK2GPR34PTPN1FFAR1PPARG
SCHEMBL3497029 0.94 GPR34 (0.53) CDK2GPR34PTPN1PPARGYAP1
SCHEMBL3501132 0.93 CDK2 (0.49) CDK2GPR34PTPN1FFAR1YAP1
SCHEMBL3501133 0.93 CDK2 (0.49) CDK2GPR34PTPN1FFAR1YAP1
SCHEMBL3498647 0.93 GPR34 (0.54) CDK2GPR34PTPN1FFAR1ALOX5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100130737-A1 Regulating Agent of GPR34 Receptor Function TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-27 US disclosed
EP-1849465-A1 AGENT FOR CONTROLLING FUNCTION OF GPR34 RECEPTOR Takeda Pharmaceutical Company Limited (JP) 2007-10-31 EP 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 (1 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-20100130737-A1 Regulating Agent of GPR34 Receptor Function GPR34, GPR4, GPR6 CDK2 2075/4885GPR34 1/4885PTPN1 3494/4885

“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.