SCHEMBL8803243

SCHEMBL8803243

CCCCCCCCn1c(Cc2ccc(Br)cc2)cc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.46
THRB P10828 1/20 0.43
TLR8 Q9NR97 2/20 0.42
KDM4E B2RXH2 2/20 0.40
HTT P42858 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
AGTR1 P30556 1/20 0.39
AGTR2 P50052 1/20 0.39
TP53 P04637 3/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
OXER1 Q8TDS5 1/20 0.38

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
SCHEMBL7409597 1.00 CNR2 (0.46) CNR2THRBTLR8KDM4EHTT
SCHEMBL8801906 0.99 CNR2 (0.46) CNR2THRBTLR8KDM4EHTT
SCHEMBL7412913 0.95 THRB (0.47) CNR2THRBTLR8KDM4ESMN1; SMN2
SCHEMBL7410652 0.89 MAPT (0.42) CNR2THRBKDM4EHTTSMN1; SMN2
SCHEMBL7414780 0.84 LPL (0.46) CNR2TLR8KDM4EHTTSMN1; SMN2
SCHEMBL8800880 0.84 LPL (0.46) CNR2TLR8KDM4EHTTSMN1; SMN2
SCHEMBL7415589 0.84 TP53 (0.44) SMN1; SMN2TP53LMNAPOLBMAPT
SCHEMBL8802217 0.82 LPL (0.44) CNR2TLR8KDM4EHTTSMN1; SMN2
SCHEMBL8426489 0.81 TLR8 (0.50) CNR2TLR8SMN1; SMN2TP53MAPT
SCHEMBL10412903 0.81 TLR8 (0.50) CNR2TLR8SMN1; SMN2TP53MAPT

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 4 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