SCHEMBL6350644

SCHEMBL6350644

CC(=O)c1cc2cc(C)ccc2c(Cc2c(O)c(C(=O)O)cc3cc(C)ccc23)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.58
POLB P06746 1/20 0.58
ME2 P23368 1/20 0.47
ME1 P48163 1/20 0.47
ME3 Q16798 1/20 0.47
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
CSNK2A1 P68400 1/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
MAOB P27338 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40
LDHA P00338 3/20 0.40

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
SCHEMBL8747621 0.94 GPR35 (0.65) GPR35POLBME2ME1ME3
SCHEMBL6350580 0.83 POLB (0.85) GPR35POLBME2ME1ME3
SCHEMBL26025326 0.80 GPR35 (0.78) GPR35POLBME2ME1ME3
SCHEMBL19202294 0.79 CSNK2A1 (0.52) GPR35POLBMEN1KMT2ACSNK2A1
SCHEMBL6010055 0.78 GPR35 (0.67) GPR35POLBME2ME1ME3
SCHEMBL6347777 0.77 MEN1 (0.50) GPR35POLBMEN1KMT2ACSNK2A1
SCHEMBL13057645 0.77 LDHA (0.54) GPR35POLBMEN1KMT2ACSNK2A1
SCHEMBL8747607 0.77 GPR35 (0.61) GPR35POLBME2ME1ME3
SCHEMBL6351094 0.77 GPR35 (0.65) GPR35POLBME2ME1ME3
SCHEMBL8747627 0.77 GPR35 (0.65) GPR35POLBME2ME1ME3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9622995-B2 Treatment of disorders associated with G protein-coupled receptor 35 (GPR35) Temple University—Of the Commonwealth System of Higher Education (US) 2017-04-18 US disclosed
US-20150265561-A1 TREATMENT OF DISORDERS ASSOCIATED WITH G PROTEIN-COUPLED RECEPTOR 35 (GPR35) NATIONAL INSTITUTES OF HEALTH 2015-09-24 US disclosed
US-9040583-B2 Treatment of disorders associated with G protein-coupled receptor 35 (GPR35) TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2015-05-26 US disclosed
US-20120122987-A1 TREATMENT OF DISORDERS ASSOCIATED WITH G PROTEIN-COUPLED RECEPTOR 35 (GPR35) TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-05-17 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 (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-20120122987-A1 TREATMENT OF DISORDERS ASSOCIATED WITH G PROTEIN-COUPLED RECEPTOR 35 (GPR35) GPR35, GPR68, GRM5 GPR35 1/4885POLB 4617/4885ME2 2603/4885
US-20150265561-A1 TREATMENT OF DISORDERS ASSOCIATED WITH G PROTEIN-COUPLED RECEPTOR 35 (GPR35) GPR35, GPR68, GRM5 GPR35 1/4885POLB 4617/4885ME2 2603/4885

“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.