SCHEMBL7412913

SCHEMBL7412913

CCCCn1c(Cc2ccc(Br)cc2)cc2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.47
CNR2 P34972 3/20 0.42
TP53 P04637 2/20 0.40
MAPT P10636 2/20 0.40
AGTR1 P30556 1/20 0.40
AGTR2 P50052 1/20 0.40
TLR8 Q9NR97 1/20 0.40
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CXCR3 P49682 1/20 0.39
KDM4E B2RXH2 2/20 0.38
HPGD P15428 2/20 0.38
GALR3 O60755 1/20 0.38
NR2F2 P24468 1/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 1/20 0.38
PGR P06401 2/20 0.38
RORA P35398 2/20 0.38
RORC P51449 2/20 0.38
RORB Q92753 2/20 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
SCHEMBL8801906 0.96 CNR2 (0.46) THRBCNR2TP53MAPTAGTR1
SCHEMBL8803243 0.95 CNR2 (0.46) THRBCNR2TP53MAPTAGTR1
SCHEMBL7409597 0.95 CNR2 (0.46) THRBCNR2TP53MAPTAGTR1
SCHEMBL7410652 0.92 MAPT (0.42) THRBCNR2TP53MAPTAGTR1
SCHEMBL7415589 0.86 TP53 (0.44) TP53MAPTPOLBSMN1; SMN2CXCR3
SCHEMBL7412797 0.84 KMT2A (0.43) THRBCNR2TP53TLR8SMN1; SMN2
SCHEMBL7410321 0.83 SMN1; SMN2 (0.45) THRBCNR2TP53MAPTSMN1; SMN2
SCHEMBL8803837 0.83 ALDH1A1 (0.39) THRBCNR2TP53MAPTAGTR1
SCHEMBL8801176 0.83 PSEN1 (0.42) CNR2TP53MAPTSMN1; SMN2KDM4E
SCHEMBL7408857 0.83 CA1 (0.43) CNR2AGTR1AGTR2TLR8SMN1; SMN2

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