SCHEMBL6234318

SCHEMBL6234318

O=Cc1cc2c(n1Cl)-c1ccccc1Oc1ccccc1-2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
P2RX4 Q99571 1/20 0.33
ELANE P08246 2/20 0.32
MAOB P27338 3/20 0.31
MAOA P21397 2/20 0.31
STK17B O94768 2/20 0.31
TOP1 P11387 1/20 0.31
TOP2A P11388 1/20 0.31
SETD7 Q8WTS6 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC4 P56524 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC7 Q8WUI4 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC10 Q969S8 1/20 0.30
HDAC11 Q96DB2 1/20 0.30

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
SCHEMBL5227319 0.69 NPC1 (0.36)
SCHEMBL5693983 0.64 MAPK1 (0.61) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL19537981 0.64 MAPK1 (0.61) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL3888313 0.64 CYP2A6 (0.42) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL5227751 0.61 CYP2A6 (0.43) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL5705789 0.59 CYP1A2 (0.40) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL9421176 0.59 TOP1 (0.41) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL4599247 0.58 ALOX15 (0.52) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL30567320 0.58 TDP1 (0.68) MAPK1KDM4EATMCYP1A2CYP2D6
SCHEMBL16801212 0.58 ALOX5 (0.42) MAPK1KDM4EATMP2RX4HDAC3

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-1506202-A1 1-AZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARTION THEREOF Pliva-Istrazivacki Institut D.D.O. (HR) 2005-02-16 EP disclosed
WO-2003097648-A1 1-AZA-DIBENZOAZULENES AS INHIBITORS OF TUMOUR NECROSIS FACTOR PRODUCTION AND INTERMEDIATES FOR THE PREPARTION THEREOF PLIVA - ISTRAZIVACKI INSTITUT D.O.O. (HR) 2003-11-27 WO disclosed