SCHEMBL8567705

SCHEMBL8567705

C=C(Cc1ccccn1)C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
POLB P06746 1/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 2/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 2/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA5A P35218 1/20 0.42

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
SCHEMBL4495564 0.85 RAB9A (0.50) SMN1; SMN2RAB9ANPC1POLBCYP1A2
SCHEMBL4980469 0.84 CTDSP1 (0.48) SMN1; SMN2MEN1KMT2ARAB9ANPC1
SCHEMBL21117699 0.81 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2ARAB9ANPC1
SCHEMBL29390571 0.80 SMN1; SMN2 (0.53) SMN1; SMN2MEN1KMT2ARAB9ANPC1
SCHEMBL78000 0.80 SMN1; SMN2 (0.53) SMN1; SMN2MEN1KMT2ARAB9ANPC1
SCHEMBL9284113 0.79 CYP3A4 (0.44) SMN1; SMN2MEN1KMT2ARAB9ANPC1
Water SCHEMBL7798110 0.78 SMN1; SMN2 (0.51) SMN1; SMN2MEN1KMT2ARAB9ANPC1
Hydrochloric Acid SCHEMBL7500894 0.78 SMN1; SMN2 (0.51) SMN1; SMN2MEN1KMT2ARAB9ANPC1
SCHEMBL4283627 0.75 HRH1 (0.52) SMN1; SMN2RAB9ANPC1POLBLMNA
SCHEMBL18415567 0.74 SMN1; SMN2 (0.75) SMN1; SMN2MEN1KMT2ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5726218-A Photo-conductive composition and CRT bulb having photo-conductive layer formed of the same SAMSUNG DISPLAY DEVICES CO., LTD. (KR) 1998-03-10 US disclosed