SCHEMBL7471849

SCHEMBL7471849

Cc1cc(=O)n(Cc2ccc(-n3cc(Cl)cc3-c3nnn[nH]3)cc2)c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
KDM4E B2RXH2 9/20 0.39
ALDH1A1 P00352 7/20 0.39
GAA P10253 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HPGD P15428 3/20 0.39
ATM Q13315 1/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
MAPT P10636 2/20 0.37
TSHR P16473 1/20 0.37
NQO2 P16083 1/20 0.36
P2RX4 Q99571 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
USP2 O75604 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL7467991 0.75 NR1H4 (0.38) KDM4ELMNAHTTSMN1; SMN2MAPT
SCHEMBL5444674 0.75 MEN1 (0.81) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL7469162 0.74 POLB (0.36) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL9308540 0.71 MEN1 (0.45) MEN1KMT2A
SCHEMBL9040172 0.71 AGTR2 (0.49)
SCHEMBL9040197 0.71 AGTR1 (0.42)
SCHEMBL30783416 0.71 MEN1 (1.00) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL377486 0.71 MEN1 (1.00) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL9309979 0.70 AGTR2 (0.35)
SCHEMBL7472677 0.70 RAB9A (0.36) LMNAHTTSMN1; SMN2MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993016071-A1 HETEROCYCLIC DERIVATIVES AS ANGIOTENSIN II ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-08-19 WO disclosed