SCHEMBL6661397

SCHEMBL6661397

Cc1ccccc1C(=O)Nc1ccc(O)c(-c2cc(C3CCC3)n(C(=O)NCCc3ccccc3)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CRACR2A Q9BSW2 4/20 0.45
▸ AVPR2 P30518 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ACKR3 P25106 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ HPGD P15428 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ADRB3 P13945 1/20 0.37
▸ FFAR1 O14842 1/20 0.37
▸ PTGES O14684 1/20 0.36
▸ USP2 O75604 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL6620553 0.89 RAB9A (0.42) ALDH1A1POLBACKR3KDM4CHPGD
SCHEMBL6618475 0.89 RAB9A (0.42) ALDH1A1POLBSMN1; SMN2MAPTKDM4C
SCHEMBL6615270 0.88 CRACR2A (0.44) CRACR2AALDH1A1SMN1; SMN2MAPTACKR3
SCHEMBL6616751 0.88 CRACR2A (0.45) CRACR2AAVPR2ALDH1A1POLBSMN1; SMN2
SCHEMBL6620003 0.87 RAB9A (0.39) CRACR2AALDH1A1POLBSMN1; SMN2MAPT
SCHEMBL6621561 0.87 SMN1; SMN2 (0.40) ALDH1A1POLBSMN1; SMN2MAPTACKR3
SCHEMBL6616043 0.87 MAPT (0.43) ALDH1A1POLBSMN1; SMN2MAPTMEN1
SCHEMBL6615419 0.86 MAPT (0.40) ALDH1A1SMN1; SMN2MAPTACKR3KDM4C
SCHEMBL6622540 0.86 RAB9A (0.44) ALDH1A1POLBSMN1; SMN2MAPTACKR3
SCHEMBL6615757 0.85 KDM4C (0.40) CRACR2AALDH1A1POLBSMN1; SMN2MAPT

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
Send feedback