SCHEMBL7414592

SCHEMBL7414592

Cc1ccc(O)cc1CC(C)(C)NC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.41
TSHR P16473 2/20 0.39
CYP3A4 P08684 2/20 0.39
RECQL P46063 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
BLM P54132 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
RAB9A P51151 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ESR1 P03372 1/20 0.36
ESRRB O95718 1/20 0.35
ESRRG P62508 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EGFR P00533 1/20 0.35

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
SCHEMBL7408911 0.79 SSTR4 (0.59) SSTR4TSHRCYP3A4MEN1KMT2A
SCHEMBL4171208 0.77 ESR1 (0.59) TSHRCYP3A4MEN1KMT2ABLM
SCHEMBL7412458 0.77 NPC1 (0.46) SSTR4MEN1KMT2AALDH1A1CYP2C9
SCHEMBL8802364 0.74 KDM4E (0.41) SSTR4TSHRMEN1KMT2AALDH1A1
SCHEMBL8801272 0.74 HDAC3 (0.42) SSTR4TSHR
SCHEMBL8800587 0.73 KDM4E (0.46) SSTR4TSHRCYP3A4MEN1KMT2A
SCHEMBL7412315 0.72 MEN1 (0.46) TSHRMEN1KMT2AALDH1A1LMNA
SCHEMBL31305638 0.72 CYP3A4 (0.50) TSHRCYP3A4RECQLESR1ESRRB
SCHEMBL2015021 0.72 CYP3A4 (0.50) TSHRCYP3A4RECQLESR1ESRRB
SCHEMBL8802782 0.70 ALDH1A1 (0.42) SSTR4CYP3A4MEN1KMT2AALDH1A1

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