SCHEMBL2643736

SCHEMBL2643736

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCGR P47871 6/20 0.51
PLA2G10 O15496 1/20 0.51
GIPR P48546 1/20 0.49
KCNH2 Q12809 1/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
GSR P00390 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 2/20 0.45
PKM P14618 1/20 0.45
HTT P42858 1/20 0.45
MAT2A P31153 1/20 0.45
PPARG P37231 1/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.42
NOTUM Q6P988 1/20 0.42
NOD2 Q9HC29 1/20 0.42

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
SCHEMBL2642765 0.82 PLA2G10 (0.52) GCGRPLA2G10GIPRKCNH2HTT
SCHEMBL2643230 0.81 GCGR (0.55) GCGRPLA2G10GIPRKCNH2HTT
SCHEMBL721418 0.81 GCGR (0.57) GCGRPLA2G10GIPRKCNH2MAT2A
SCHEMBL2643458 0.78 GCGR (0.54) GCGRPLA2G10GIPRKCNH2MAT2A
SCHEMBL2643861 0.78 GCGR (0.56) GCGRPLA2G10GIPRKCNH2HTT
SCHEMBL9987241 0.78 PLA2G10 (0.47) GCGRPLA2G10ALDH1A1KDM4EHTT
SCHEMBL2643993 0.75 GCGR (0.52) GCGRPLA2G10GIPRKCNH2MAT2A
SCHEMBL2643376 0.74 GCGR (0.43) GCGRPLA2G10KDM4EPOLBMAPT
SCHEMBL1253237 0.73 RXFP1 (0.56) NPSR1ALDH1A1KDM4ELMNAMAPT
SCHEMBL12930106 0.73 NOD2 (0.58) ALDH1A1PPARGPOLBMAPTNOD2

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.