SCHEMBL7412797

SCHEMBL7412797

CCCCn1c(Cc2ccc(Br)cc2)cc2cc(C)ccc21

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TLR8 Q9NR97 2/20 0.40
PGR P06401 3/20 0.40
RORA P35398 3/20 0.40
RORC P51449 3/20 0.40
RORB Q92753 3/20 0.40
THRB P10828 1/20 0.36
CNR2 P34972 2/20 0.36
TP53 P04637 2/20 0.33
LMNA P02545 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
DNM1 Q05193 1/20 0.33
ADORA2B P29275 1/20 0.33
CNR1 P21554 1/20 0.32

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
SCHEMBL8803837 0.86 ALDH1A1 (0.39) KMT2AKDM4EMEN1ALDH1A1GAA
SCHEMBL8801176 0.86 PSEN1 (0.42) KMT2AKDM4EMEN1ALDH1A1GAA
SCHEMBL7412913 0.84 THRB (0.47) KDM4EALDH1A1GAASMN1; SMN2TLR8
SCHEMBL7412404 0.84 ERBB2 (0.41) KMT2AKDM4EMEN1ALDH1A1GAA
SCHEMBL7418136 0.84 KMT2A (0.43) KMT2AKDM4EMEN1ALDH1A1GAA
SCHEMBL8802291 0.82 THRB (0.34) KMT2AKDM4EMEN1ALDH1A1GAA
SCHEMBL8801906 0.81 CNR2 (0.46) KDM4ESMN1; SMN2TLR8THRBCNR2
SCHEMBL8803243 0.80 CNR2 (0.46) KDM4ESMN1; SMN2TLR8THRBCNR2
SCHEMBL7409597 0.80 CNR2 (0.46) KDM4ESMN1; SMN2TLR8THRBCNR2
SCHEMBL8800741 0.79 TLR8 (0.40) KMT2AKDM4EMEN1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0640080-B1 SUBSTITUTED INDOLES AS ANGIOTENSIN II ANTAGONISTS SYNTEX INC (US) 1997-10-22 EP disclosed
EP-0640080-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS. SYNTEX INC (US) 1995-03-01 EP disclosed
US-5380739-A Angiotensin II antagonists SYNTEX (U.S.A.) INC. (US) 1995-01-10 US disclosed
WO-1993023391-A1 SUBSTITUTED INDOLES AND AZAINDOLES AS ANGIOTENSIN II ANTAGONISTS SYNTEX (U.S.A.) INC. (US) 1993-11-25 WO disclosed
US-5212195-A Substituted indole antagonists derivatives which are angiotensin II SYNTEX (U.S.A.) INC. (US) 1993-05-18 US disclosed