SCHEMBL9713595

SCHEMBL9713595

CCCCCCCOc1cccc(C(=O)Nc2cccc(O)c2)c1

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 8/20 0.78
THRB P10828 1/20 0.73
SMPD1 P17405 3/20 0.67
SMN1; SMN2 Q16637 2/20 0.60
MAPT P10636 2/20 0.60
KMT2A Q03164 5/20 0.59
TSHR P16473 2/20 0.58
MAPK1 P28482 1/20 0.58
MEN1 O00255 4/20 0.58
ADRB2 P07550 2/20 0.58
USP2 O75604 1/20 0.58
ALDH1A1 P00352 1/20 0.58
LMNA P02545 1/20 0.58
GAA P10253 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58

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
SCHEMBL9713307 0.89 NR1H4 (0.76) NR1H4THRBSMN1; SMN2MAPTKMT2A
SCHEMBL8389461 0.87 NR1H4 (0.65) NR1H4THRBSMPD1KMT2AMEN1
SCHEMBL9713045 0.85 NR1H4 (0.73) NR1H4THRBSMPD1SMN1; SMN2MAPT
SCHEMBL11325837 0.85 SMPD1 (0.82) NR1H4THRBSMPD1KMT2ALMNA
SCHEMBL9712999 0.81 SMPD1 (0.67) NR1H4THRBSMPD1SMN1; SMN2KMT2A
SCHEMBL28224821 0.81 SMPD1 (1.00) NR1H4THRBSMPD1KMT2A
SCHEMBL28225521 0.81 SMPD1 (1.00) NR1H4THRBSMPD1KMT2A
SCHEMBL31194774 0.81 SMPD1 (0.80) NR1H4THRBSMPD1KMT2AMAPK1
SCHEMBL28225796 0.81 SMPD1 (1.00) NR1H4THRBSMPD1KMT2A
SCHEMBL28826745 0.79 RXFP1 (0.78) SMN1; SMN2MAPTKMT2ATSHRMEN1

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
US-5140046-A Slow reacting substance of anaphylaxis antagonists YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-08-18 US disclosed
US-4994479-A Antagonists of SRS-A(slow reacting substance of anaphylaxis); antiallergens, antiischemic agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-02-19 US disclosed
EP-0218728-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1987-04-22 EP disclosed
WO-1986005779-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-10-09 WO disclosed