SCHEMBL7230360

SCHEMBL7230360

Fc1ccc(COCCCCCBr)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.44
AGXT P21549 2/20 0.44
GBA1 P04062 1/20 0.43
UGCG Q16739 1/20 0.43
GBA2 Q9HCG7 1/20 0.43
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAOB P27338 5/20 0.37
APP P05067 1/20 0.37
NR4A2 P43354 2/20 0.37
CHRM3 P20309 1/20 0.36

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
SCHEMBL7741926 1.00 IDO1 (0.44) IDO1AGXTGBA1UGCGGBA2
SCHEMBL7236826 0.98 IDO1 (0.45) IDO1AGXTGBA1UGCGGBA2
SCHEMBL7239991 0.92 IDO1 (0.47) IDO1AGXTGBA1UGCGGBA2
SCHEMBL1964901 0.84 IDO1 (0.50) IDO1AGXTL3MBTL1MAOBAPP
SCHEMBL9574237 0.84 TAAR1 (0.39) TDP1L3MBTL1MAOB
SCHEMBL9574248 0.84 TAAR1 (0.39) IDO1AGXTMAOB
SCHEMBL7010371 0.81 IDO1 (0.44) IDO1AGXTGBA1UGCGGBA2
SCHEMBL7228810 0.81 TAAR1 (0.41) IDO1AGXTMAOB
SCHEMBL1008118 0.81 GBA1 (0.49) IDO1AGXTGBA1UGCGGBA2
SCHEMBL4229986 0.81 L3MBTL1 (0.54) IDO1GBA1UGCGGBA2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1129599-C Substituted benzothiazine/oxazine-2-amine derivatives, co-preparation method and application thereof PF MEDICAMENT (FR) 2003-12-03 CN disclosed
US-6531469-B1 Treatment of myocardial ischemia, chronic stable angina, unstable angina and prinzmetal's angina attacks, silent cardiac ischemia, reinfarction, reocclusion and restenosis PIERRE FABRE MEDICAMENT (FR) 2003-03-11 US disclosed
EP-1144408-B1 SUBSTITUTED 1-(PIERIDIN-4-YL)-3-(ARYL) ISOTHIOUREAS THEIR PREPARATION AND THERAPEUTIC APPLICATION PF MEDICAMENT (FR) 2002-09-25 EP disclosed
EP-1144408-A1 SUBSTITUTED 1-(PIERIDIN-4-YL)-3-(ARYL) ISOTHIOUREAS THEIR PREPARATION AND THERAPEUTIC APPLICATION PIERRE FABRE MEDICAMENT (FR) 2001-10-17 EP disclosed
WO-2000043391-A1 SUBSTITUTED 1-(PIERIDIN-4-YL)-3-(ARYL) ISOTHIOUREAS THEIR PREPARATION AND THERAPEUTIC APPLICATION PIERRE FABRE MEDICAMENT (FR) 2000-07-27 WO disclosed