SCHEMBL6615915

SCHEMBL6615915

COc1ccccc1C(=O)Nc1ccc(O)c(-c2cc(C3CC3)n(C(=O)NCc3ccc(Cl)c(Cl)c3)n2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAX8 Q06710 1/20 0.49
▸ CCR3 P51677 1/20 0.43
▸ WDR5 P61964 1/20 0.42
▸ CHRM5 P08912 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ CHRM3 P20309 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ PNLIP P16233 1/20 0.40
▸ KCNMA1 Q12791 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ MAPT P10636 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ RAB9A P51151 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
SCHEMBL6615822 0.91 KCNMA1 (0.41) PAX8KDM4EKCNMA1MAPTSMN1; SMN2
SCHEMBL6615384 0.91 TP53 (0.45) KDM4EMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL6615311 0.90 CHRM5 (0.42) PAX8CHRM5CHRM1CHRM3KDM4E
SCHEMBL6619099 0.89 KCNK3 (0.43) PAX8KDM4EKCNMA1MAPTSMN1; SMN2
SCHEMBL6618795 0.88 HRH3 (0.40) PAX8MAPTTP53RAB9ALMNA
SCHEMBL6616443 0.88 CRACR2A (0.42) PAX8CCR3CHRM1PNLIPKCNMA1
SCHEMBL6683281 0.86 MAPT (0.40) PAX8CHRM5CHRM1CHRM3MAPT
SCHEMBL6618884 0.86 POLB (0.42) KDM4EKCNMA1MAPTSMN1; SMN2MEN1
SCHEMBL6620593 0.86 HRH3 (0.39) MAPTRAB9A
SCHEMBL6616043 0.85 MAPT (0.43) KDM4EMAPTSMN1; SMN2MEN1KMT2A

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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