SCHEMBL7414780

SCHEMBL7414780

CCCCCCn1c(Cc2ccc(B(O)O)cc2)cc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LPL P06858 6/20 0.46
LIPG Q9Y5X9 6/20 0.46
TRPV1 Q8NER1 1/20 0.46
MGLL Q99685 1/20 0.46
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
KDM4E B2RXH2 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CNR2 P34972 4/20 0.40
TLR8 Q9NR97 1/20 0.40
AGTR1 P30556 1/20 0.39
AGTR2 P50052 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
HPGD P15428 1/20 0.39
OXER1 Q8TDS5 4/20 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
SCHEMBL8800880 1.00 LPL (0.46) LPLLIPGTRPV1MGLLCA1
SCHEMBL8802217 0.99 LPL (0.44) LPLLIPGTRPV1MGLLCA1
SCHEMBL7408857 0.95 CA1 (0.43) LPLLIPGTRPV1MGLLCA1
SCHEMBL9172351 0.90 LPL (0.42) LPLLIPGTRPV1MGLLCA1
SCHEMBL7414582 0.85 LPL (0.45) LPLLIPGTRPV1MGLLCA1
SCHEMBL8803243 0.84 CNR2 (0.46) KDM4EHTTSMN1; SMN2CNR2TLR8
SCHEMBL7409597 0.84 CNR2 (0.46) KDM4EHTTSMN1; SMN2CNR2TLR8
SCHEMBL8801906 0.83 CNR2 (0.46) KDM4EHTTSMN1; SMN2CNR2TLR8
SCHEMBL8802309 0.82 MAPT (0.40) LPLLIPGKDM4EHTTSMN1; SMN2
SCHEMBL7418136 0.81 KMT2A (0.43) LPLLIPGTRPV1MGLLCA1

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