SCHEMBL10144207

SCHEMBL10144207

CCc1ccc(-c2ccc(C=O)s2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.49
APP P05067 1/20 0.45
ALDH1A1 P00352 5/20 0.44
CYP2E1 P05181 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2A6 P11509 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2B6 P20813 1/20 0.42
CYP2C19 P33261 1/20 0.42
MAPT P10636 4/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39

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
SCHEMBL158329 0.88
SCHEMBL27982838 0.84 ALDH1A1 (0.47) DPP4APPALDH1A1CYP2E1CYP3A4
Lithium Ion SCHEMBL27982839 0.82 ALDH1A1 (0.46) DPP4APPALDH1A1CYP2E1CYP3A4
SCHEMBL13621245 0.81 DPP4 (0.41) DPP4ALDH1A1CYP2E1CYP3A4CYP2A6
SCHEMBL278904 0.81 DPP4 (0.65) DPP4APPALDH1A1CYP2E1CYP3A4
SCHEMBL774352 0.81 DPP4 (0.49) DPP4APPALDH1A1CYP2E1CYP3A4
SCHEMBL405828 0.81 MAPT (0.50) DPP4APPALDH1A1CYP2E1CYP3A4
SCHEMBL805103 0.80 DPP4 (0.45) DPP4APPALDH1A1CYP2E1CYP3A4
SCHEMBL8013135 0.80 ALDH1A1 (0.41) DPP4APPALDH1A1CYP2E1CYP3A4
SCHEMBL1756469 0.80 ALDH1A1 (0.41) DPP4APPALDH1A1CYP2E1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120022116-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX CORNING INCORPORATED 2012-01-26 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 (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-20120022116-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PATHOLOGICAL CONDITION(S) RELATED TO GPR35 AND/OR GPR35-HERG COMPLEX GPR35, GPR65, GPR68 DPP4 3281/4885APP 1067/4885ALDH1A1 1572/4885

“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.