SCHEMBL6614045

SCHEMBL6614045

CC(=O)Nc1ccc(O)c(-c2cc(C3CCC3)n(C(=O)NCc3ccc(Cl)c(Cl)c3)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.41
▸ HRH3 Q9Y5N1 3/20 0.40
▸ HSD17B10 Q99714 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TAOK1 Q7L7X3 2/20 0.36
▸ TAOK3 Q9H2K8 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ KDM5A P29375 1/20 0.36
▸ KDM4D Q6B0I6 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36
▸ KDM5B Q9UGL1 1/20 0.36
▸ KDM3A Q9Y4C1 1/20 0.36
▸ MAPT P10636 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ WDR5 P61964 1/20 0.36
▸ TP53 P04637 2/20 0.35

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
SCHEMBL6620401 0.90 HRH3 (0.39) EPHX2HRH3TAOK1TAOK3MEN1
SCHEMBL6616492 0.90 HRH3 (0.38) EPHX2HRH3SMN1; SMN2TAOK1TAOK3
SCHEMBL6616656 0.89 LMNA (0.39) EPHX2HRH3SMN1; SMN2MEN1KMT2A
SCHEMBL6618795 0.88 HRH3 (0.40) EPHX2HRH3MAPTLMNARAB9A
SCHEMBL6616443 0.88 CRACR2A (0.42) HRH3MAPTPTGES
SCHEMBL6618824 0.88 HRH3 (0.41) EPHX2HRH3TAOK1TAOK3PTGES
SCHEMBL6618198 0.87 RAB9A (0.41) HRH3HSD17B10SMN1; SMN2MEN1KMT2A
SCHEMBL6616965 0.86 HRH3 (0.40) EPHX2HRH3SMN1; SMN2TAOK1TAOK3
SCHEMBL6617392 0.86 MEN1 (0.41) HRH3SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL6617603 0.86 CHRNE (0.45) EPHX2MEN1KMT2AKDM5AKDM4D

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
EP-1458379-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2004-09-22 — — EP claimed
WO-2003051358-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2003-06-26 — — WO claimed
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