SCHEMBL7361674

SCHEMBL7361674

O=c1oc(-c2cccc(Br)c2)c2[nH]cccc1-2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
TSHR P16473 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CSNK1D P48730 1/20 0.38
GABRP O00591 3/20 0.37
GABRD O14764 3/20 0.37
GABRA1 P14867 3/20 0.37
GABRB1 P18505 3/20 0.37
GABRG2 P18507 3/20 0.37
GABRB3 P28472 3/20 0.37
GABRA5 P31644 3/20 0.37
GABRA3 P34903 3/20 0.37
GABRA2 P47869 3/20 0.37
GABRB2 P47870 3/20 0.37
GABRA4 P48169 3/20 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
SCHEMBL7359478 0.83 MIF (0.42) MAOBKDM4EMAPTGABRPGABRD
SCHEMBL7363661 0.79 MEN1 (0.51) MAOBSMN1; SMN2NPC1RAB9ATSHR
SCHEMBL7365563 0.77 CDK8 (0.46) NPC1RAB9AMAPTGABRG2GABRB3
SCHEMBL7364846 0.75 NPC1 (0.43) MAOBNPC1RAB9ATSHRKDM4E
SCHEMBL28647816 0.73 MAOB (0.45) MAOBSMN1; SMN2NPC1RAB9AKDM4E
SCHEMBL7367312 0.71 ALDH1A1 (0.47) MAOBSMN1; SMN2NPC1RAB9ATSHR
SCHEMBL7366344 0.70 MAOB (0.50) MAOBSMN1; SMN2NPC1RAB9ATSHR
SCHEMBL7371168 0.70 MAPT (0.41) KDM4EMAPTIDO1ALDH1A1POLB
SCHEMBL7370381 0.70 NR4A2 (0.37) KDM4EALDH1A1TDP2
SCHEMBL7363579 0.68 MAPT (0.49) SMN1; SMN2KDM4EMAPTHSD17B10TP53

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5716954-A ANTIINFLAMMATORY AGENT, ANTIHISTAMINES, IMMUNOSUPPRESSION,AUTOIMMUNE DISEASES SYNTEX U.S.A. INC. (US) 1998-02-10 US disclosed
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed