SCHEMBL8999375

SCHEMBL8999375

CON=C(CO)C(=O)N(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA4 P43681 1/20 0.39
KMT2A Q03164 5/20 0.39
RAB9A P51151 3/20 0.38
MEN1 O00255 3/20 0.38
NPC1 O15118 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
POLB P06746 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL8537305 0.80 RAB9A (0.43) TSHRALDH1A1KDM4EMAPTRXFP1
SCHEMBL17704773 0.74 KMT2A (0.53) TSHRALDH1A1KDM4EKMT2ARAB9A
SCHEMBL8999307 0.72 CXCR1 (0.45) ALDH1A1KDM4EMAPTKMT2ARAB9A
SCHEMBL9754814 0.72 KDM4E (0.48) ALDH1A1KDM4EMAPTRXFP1KMT2A
SCHEMBL5601309 0.71 KMT2A (0.56) ALDH1A1KDM4EKMT2AMEN1POLB
SCHEMBL9456596 0.70 KMT2A (0.50) TSHRALDH1A1KDM4EKMT2ARAB9A
SCHEMBL31339223 0.69 HTT (0.49) KDM4EKMT2ARAB9AMEN1NPC1
SCHEMBL28569085 0.69 KMT2A (0.42) ALDH1A1KDM4ECHRNB2CHRNB4CHRNA3
SCHEMBL1318083 0.68
SCHEMBL11533493 0.68 KMT2A (0.51) TSHRALDH1A1KDM4EMAPTCHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506263-A Benzyl derivatives and pesticides containing them BASF AKTIENGESELLSCHAFT (DE) 1996-04-09 US disclosed
US-5416110-A Benzyl derivatives and pesticides containing them BASF AKTIENGESELLSCHAFT (DE) 1995-05-16 US disclosed