SCHEMBL6949166

SCHEMBL6949166

CON(C)C(=O)Nc1c(C(=O)c2cccc(Cl)c2)[nH]c2cc(Cl)ccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.43
PKM P14618 1/20 0.43
MAPT P10636 4/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
NPC1 O15118 2/20 0.39
GAA P10253 1/20 0.39
ALOX12 P18054 1/20 0.39
TP53 P04637 2/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.38
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37

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
SCHEMBL6951194 0.93 RAB9A (0.44) RAB9APKMMAPTKDM4EALDH1A1
SCHEMBL6954922 0.89 PKM (0.41) RAB9APKMMAPTKDM4EALDH1A1
SCHEMBL6949204 0.88 ENPP2 (0.38) RAB9APKMMAPTKDM4EALDH1A1
SCHEMBL7501433 0.84 KDM4E (0.49) RAB9AMAPTKDM4EALDH1A1HPGD
SCHEMBL7504271 0.83 KDM4E (0.47) KDM4EMEN1KMT2ATP53ALOX15
SCHEMBL6954951 0.82 ENPP2 (0.44) ALOX15
SCHEMBL6949310 0.82 KCNK3 (0.40) MAPTKDM4EHPGDMEN1KMT2A
SCHEMBL6947058 0.82 PTGS2 (0.42) RAB9APKMMAPTKDM4EALDH1A1
SCHEMBL6954685 0.81 MEN1 (0.43) RAB9AMAPTKDM4EALDH1A1HPGD
SCHEMBL6954220 0.81 KCNK3 (0.40) MAPTKDM4EHPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0985666-B1 Substituted indole compounds as COX-2 inhibitors PFIZER (US) 2003-11-05 EP claimed
US-6277878-B1 ANTIINFLAMMATORY AGENTS; ANALGESICS PFIZER INC 2001-08-21 US claimed
EP-0985666-A1 Substituted indole compounds as COX-2 inhibitors PFIZER INC. (US) 2000-03-15 EP claimed
EP-0985666-B1 Substituted indole compounds as COX-2 inhibitors PFIZER (US) 2003-11-05 EP disclosed
US-6277878-B1 ANTIINFLAMMATORY AGENTS; ANALGESICS PFIZER INC 2001-08-21 US disclosed
EP-0985666-A1 Substituted indole compounds as COX-2 inhibitors PFIZER INC. (US) 2000-03-15 EP disclosed