SCHEMBL6177612

SCHEMBL6177612

Nc1ccc(C(=O)O)c2nc(Cl)cn12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 3/20 0.41
GABRD O14764 3/20 0.41
GABRA1 P14867 3/20 0.41
GABRB1 P18505 3/20 0.41
GABRG2 P18507 3/20 0.41
GABRB3 P28472 3/20 0.41
GABRA5 P31644 3/20 0.41
GABRA3 P34903 3/20 0.41
GABRA2 P47869 3/20 0.41
GABRB2 P47870 3/20 0.41
GABRA4 P48169 3/20 0.41
GABRE P78334 3/20 0.41
GABRA6 Q16445 3/20 0.41
GABRG1 Q8N1C3 3/20 0.41
GABRG3 Q99928 3/20 0.41
GABRQ Q9UN88 3/20 0.41
KDM4E B2RXH2 6/20 0.39
CASP1 P29466 2/20 0.39
CASP7 P55210 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL9088819 0.69 DHODH (0.61) KDM4ECASP1CASP7HSD17B10ALDH1A1
SCHEMBL17729432 0.67 SMN1; SMN2 (0.39) KDM4ECASP1CASP7HSD17B10ALDH1A1
SCHEMBL393852 0.66 GABRP (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL631872 0.65 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL6178995 0.64 DHODH (0.48) KDM4ECASP1SMN1; SMN2RAB9ADHODH
SCHEMBL25401698 0.64 KDM4E (0.51) KDM4ECASP1CASP7HSD17B10ALDH1A1
SCHEMBL25398458 0.64 NAPRT (0.35) KDM4EALDH1A1SMN1; SMN2RAB9AMAPT
SCHEMBL29524409 0.62 GABRP (0.66) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL398966 0.62 GABRP (0.66) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL15530203 0.62 GABRP (0.60) GABRPGABRDGABRA1GABRB1GABRG2

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
EP-1440071-B1 IMIDAZOPYRIDINE COMPOUNDS AS 5-HT 4? RECEPTOR MODULATORS PFIZER (US) 2005-10-26 EP disclosed
US-20040034226-A1 Imidazopyridine compounds as 5-HT4 receptor modulators UCHIDA CHIKARA (JP) 2004-02-19 US disclosed
US-6624162-B2 5-HT4 receptor binding activity, and thus are useful for the treatment of gastroesophageal reflux disease, non-ulcer dyspepsia, Functional dyspepsia, irritable bowel syndrome or the like in mammalian, especially humans. PFIZER INC. 2003-09-23 US disclosed
US-20030092699-A1 Imidazopyridine compounds as 5-HT4 receptor modulators PFIZER INC. 2003-05-15 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-20030092699-A1 Imidazopyridine compounds as 5-HT4 receptor modulators HTR4, HRH4, HRH2 GABRP 263/4885GABRD 417/4885GABRA1 317/4885
US-20040034226-A1 Imidazopyridine compounds as 5-HT4 receptor modulators HRH4, HTR4, HRH2 GABRP 248/4885GABRD 436/4885GABRA1 316/4885

“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.