SCHEMBL8169667

SCHEMBL8169667

O=CCN(C=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.38
TSHR P16473 2/20 0.38
GLA P06280 1/20 0.38
NPSR1 Q6W5P4 2/20 0.34
ALOX15 P16050 2/20 0.34
HTT P42858 3/20 0.33
KMT2A Q03164 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 2/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL29959951 0.83 ESR1 (0.42) ALDH1A1TSHRGLAKMT2AMEN1
SCHEMBL277886 0.83 ESR1 (0.42) ALDH1A1TSHRGLAKMT2AMEN1
SCHEMBL31116625 0.79 TSHR (0.48) ALDH1A1TSHRGLAALOX15HTT
SCHEMBL305842 0.79 TSHR (0.48) ALDH1A1TSHRGLAALOX15HTT
SCHEMBL7670007 0.78 ALDH1A1 (0.36) ALDH1A1TSHRGLANPSR1ALOX15
SCHEMBL9435737 0.77 ALDH1A1 (0.38) ALDH1A1TSHRGLANPSR1ALOX15
SCHEMBL7668430 0.77 ALDH1A1 (0.42) ALDH1A1TSHRGLANPSR1ALOX15
SCHEMBL28278441 0.77 ALDH1A1 (0.38) ALDH1A1TSHRGLANPSR1ALOX15
SCHEMBL10738575 0.77 ALDH1A1 (0.42) ALDH1A1TSHRGLANPSR1ALOX15
SCHEMBL7230081 0.76 ALDH1A1 (0.42) ALDH1A1TSHRGLANPSR1ALOX15

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0759354-B1 LAMINATE OF VULCANIZABLE RUBBER COMPOSITION LAYERS, PROCESS FOR PRODUCING A VULCANIZED RUBBER LAMINATE, AND RUBBER LAMINATE NIPPON ZEON CO (JP) 2000-08-16 EP disclosed
US-5855976-A HOSE, DIAPHRAGM NIPPON ZEON CO., LTD. (JP) 1999-01-05 US disclosed
EP-0759354-A1 LAMINATE OF VULCANIZABLE RUBBER COMPOSITION LAYERS, PROCESS FOR PRODUCING RUBBER LAMINATE, AND RUBBER LAMINATE NIPPON ZEON CO., LTD. (JP) 1997-02-26 EP disclosed