SCHEMBL9620745

SCHEMBL9620745

CCCCCc1ccc(-c2ccc(CCC)cc2)nc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 10/20 0.75
RAB9A P51151 9/20 0.75
NPC1 O15118 7/20 0.75
MAPT P10636 7/20 0.75
STAT3 P40763 1/20 0.75
ATM Q13315 1/20 0.75
L3MBTL1 Q9Y468 2/20 0.73
CASP3 P42574 2/20 0.73
SENP8 Q96LD8 2/20 0.73
SENP7 Q9BQF6 2/20 0.73
SENP6 Q9GZR1 2/20 0.73
NFKB1 P19838 2/20 0.69
NFKB2 Q00653 2/20 0.69
RELA Q04206 2/20 0.69
MAPK1 P28482 1/20 0.69
TP53 P04637 2/20 0.61
KDM4E B2RXH2 4/20 0.61
ALDH1A1 P00352 4/20 0.61
HPGD P15428 4/20 0.61
HSD17B10 Q99714 2/20 0.55

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
SCHEMBL7913857 1.00 SMN1; SMN2 (0.75) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL10461831 0.98 SMN1; SMN2 (0.73) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL10554982 0.98 SMN1; SMN2 (0.78) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL9621218 0.98 SMN1; SMN2 (0.78) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL10559199 0.98 SMN1; SMN2 (0.78) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL10560707 0.98 SMN1; SMN2 (0.73) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL9620803 0.98 SMN1; SMN2 (0.78) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL10463153 0.98 SMN1; SMN2 (0.73) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL9620830 0.98 SMN1; SMN2 (0.78) SMN1; SMN2RAB9ANPC1MAPTSTAT3
SCHEMBL10555751 0.98 SMN1; SMN2 (0.73) SMN1; SMN2RAB9ANPC1MAPTSTAT3

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-0283490-B1 PROCESS FOR THE PRODUCTION OF ETHANE DERIVATIVES MERCK PATENT GmbH (DE) 1992-01-08 EP disclosed
US-4879060-A 2-phenylpyridine derivatives and liquid crystal compositions including same SEIKO EPSON KABUSHIKI KAISHA (JP) 1989-11-07 US disclosed
US-4684220-A 2-phenylpyridine derivatives and liquid crystal compositions including same SEIKO EPSON KABUSHIKI KAISHA (JP) 1987-08-04 US disclosed