SCHEMBL6614537

SCHEMBL6614537

CCc1ccc(C(=O)Nc2ccc(-c3cc(C4CC4)n(C(=O)NCc4ccccc4)n3)c(O)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACKR3 P25106 4/20 0.41
▸ MAPT P10636 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ IL6 P05231 1/20 0.38
▸ STAT3 P40763 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ PPARA Q07869 1/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ EGFR P00533 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HSD17B10 Q99714 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
SCHEMBL6618316 0.92 MAPT (0.42) MAPTLMNAALDH1A1SMN1; SMN2RAB9A
SCHEMBL6616244 0.92 NAMPT (0.41) ACKR3MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL6619769 0.92 LMNA (0.40) ACKR3MAPTLMNAALDH1A1SMN1; SMN2
SCHEMBL6622810 0.92 SMN1; SMN2 (0.42) MAPTLMNAALDH1A1SMN1; SMN2RAB9A
SCHEMBL6618133 0.90 RAB9A (0.41) MAPTSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL6617061 0.90 TAOK1 (0.42) MAPTLMNARAB9ANPC1POLB
SCHEMBL6617319 0.89 RAB9A (0.40) MAPTSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL6618415 0.88 MEN1 (0.44) ACKR3MAPTLMNAALDH1A1RAB9A
SCHEMBL6616846 0.86 NAMPT (0.42) ACKR3MAPTLMNASMN1; SMN2TP53
SCHEMBL6615863 0.86 RAB9A (0.40) MAPTLMNASMN1; SMN2RAB9ANPC1

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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