SCHEMBL6169487

SCHEMBL6169487

Cc1ccc(C(=O)c2cc3ccc(Cl)cc3[nH]2)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 7/20 0.58
MEN1 O00255 2/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
KMT2A Q03164 2/20 0.57
FLT3 P36888 4/20 0.56
PDGFRB P09619 2/20 0.56
HRH4 Q9H3N8 1/20 0.51
PDGFRA P16234 1/20 0.48
GPR183 P32249 1/20 0.47
F7 P08709 1/20 0.45
F3 P13726 1/20 0.45

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
SCHEMBL6170035 0.91 MEN1 (0.63) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL6169053 0.85 GPR183 (0.58) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL6171786 0.85 MEN1 (0.57) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL6170605 0.85 MEN1 (0.78) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL6170060 0.85 MEN1 (0.57) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL6169285 0.82 RAB9A (0.65) MEN1NPC1RAB9AKMT2AFLT3
SCHEMBL6171801 0.82 ALOX15 (0.55) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL6171399 0.82 MEN1 (0.53) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL6172428 0.81 MEN1 (0.62) ALOX15MEN1NPC1RAB9AKMT2A
SCHEMBL5716749 0.80 PDGFRB (0.72) MEN1NPC1RAB9AKMT2AFLT3

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
EP-1045833-B1 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER (US) 2005-11-02 EP disclosed
US-6608070-B1 Useful for treatment of medical condition in which prostaglandins are implicated as pathogens NAKAO KAZUNARI (JP) 2003-08-19 US disclosed
CN-1284064-A 2,3-substituted indole compounds as cox-2 inhibitors PFIZER PHARMA (US) 2001-02-14 CN disclosed
EP-1045833-A1 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER INC. (US) 2000-10-25 EP disclosed
WO-1999035130-A1 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS PFIZER PHARMACEUTICALS INC. (JP) 1999-07-15 WO disclosed