SCHEMBL2643861

SCHEMBL2643861

O=C(CCC1CC1)c1cc2cc(Cl)ccc2n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCGR P47871 7/20 0.56
PLA2G10 O15496 3/20 0.49
GIPR P48546 1/20 0.46
KCNH2 Q12809 1/20 0.46
MAPT P10636 3/20 0.43
PPARG P37231 1/20 0.43
LMNA P02545 2/20 0.41
HTT P42858 2/20 0.41
MAT2A P31153 1/20 0.41
NOTUM Q6P988 1/20 0.40
PLA2G2A P14555 2/20 0.40
PLA2G5 P39877 1/20 0.40
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CHRM4 P08173 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
SCHEMBL2643230 0.83 GCGR (0.55) GCGRPLA2G10GIPRKCNH2MAPT
SCHEMBL721418 0.83 GCGR (0.57) GCGRPLA2G10GIPRKCNH2MAPT
SCHEMBL2642765 0.82 PLA2G10 (0.52) GCGRPLA2G10GIPRKCNH2MAPT
SCHEMBL2643458 0.78 GCGR (0.54) GCGRPLA2G10GIPRKCNH2PPARG
SCHEMBL2643736 0.78 GCGR (0.51) GCGRPLA2G10GIPRKCNH2MAPT
SCHEMBL2643993 0.75 GCGR (0.52) GCGRPLA2G10GIPRKCNH2PPARG
SCHEMBL2662407 0.73 GCGR (1.00) GCGRGIPRKCNH2
SCHEMBL2642999 0.73 GCGR (1.00) GCGRGIPRKCNH2
SCHEMBL3570450 0.67 PLA2G10 (0.79) PLA2G10PPARGNOTUMPLA2G2APLA2G5
SCHEMBL3198946 0.67 CCR2 (0.71) PPARG

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-7598398-B2 Acyl indoles, compositions containing such compounds and methods of use MERCK & CO., INC. (US) 2009-10-06 US disclosed
US-20070088071-A1 Acyl indoles, compositions containing such compounds and methods of use MERCK SHARP & DOHME LLC 2007-04-19 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-20070088071-A1 Acyl indoles, compositions containing such compounds and methods of use GPR119, IAPP, GLP1R GCGR 6/4885PLA2G10 909/4885GIPR 4/4885

“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.