SCHEMBL7410648

SCHEMBL7410648

CC(C)n1c(Cc2ccc(Br)cc2)cc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RORC P51449 8/20 0.42
GALR3 O60755 1/20 0.38
NR2F2 P24468 1/20 0.38
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CXCR3 P49682 1/20 0.35
ALOX5AP P20292 1/20 0.35
DNM1 Q05193 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL7416719 0.82 RORC (0.42) RORC
SCHEMBL8801682 0.80 SLC5A2 (0.44) GALR3NR2F2KMT2ACXCR3POLB
SCHEMBL8801731 0.78 TSHR (0.40) GALR3NR2F2TSHRCXCR3ALOX5AP
SCHEMBL7415589 0.78 TP53 (0.44) GALR3NR2F2MEN1LMNATSHR
SCHEMBL21323507 0.76 POLB (0.40) RORCTSHRPOLBMAPT
SCHEMBL28171021 0.76 TSHR (0.39) MEN1LMNATSHRRAB9AKMT2A
SCHEMBL7410652 0.75 MAPT (0.42) GALR3NR2F2NPSR1CXCR3TP53
SCHEMBL24462115 0.74 OPRM1 (0.45) LMNATSHRMAPT
SCHEMBL28281353 0.74 KMT2A (0.45) MEN1LMNATSHRRAB9AKMT2A
SCHEMBL7412913 0.73 THRB (0.47) RORCGALR3NR2F2CXCR3TP53

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