SCHEMBL10554231

SCHEMBL10554231

CCCc1ccc(CCc2ccc(-c3ccc(OCC)cc3)nc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.76
MAPT P10636 7/20 0.76
L3MBTL1 Q9Y468 4/20 0.76
THRB P10828 2/20 0.70
CASP3 P42574 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59
SMN1; SMN2 Q16637 10/20 0.58
NPC1 O15118 8/20 0.57
TP53 P04637 3/20 0.57
NFKB1 P19838 2/20 0.52
NFKB2 Q00653 2/20 0.52
RELA Q04206 2/20 0.52
MAPK1 P28482 1/20 0.52
KDM4E B2RXH2 5/20 0.51
ALDH1A1 P00352 4/20 0.51
PKM P14618 3/20 0.51
HPGD P15428 3/20 0.51
MITF O75030 2/20 0.51

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
SCHEMBL10553681 1.00 RAB9A (0.76) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10561035 1.00 RAB9A (0.76) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL9620900 0.97 RAB9A (0.81) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10555677 0.92 RAB9A (0.65) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10554929 0.91 RAB9A (0.86) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10555234 0.91 RAB9A (0.86) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10560836 0.91 RAB9A (0.86) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10558713 0.91 RAB9A (0.72) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10554647 0.91 RAB9A (0.72) RAB9AMAPTL3MBTL1THRBCASP3
SCHEMBL10555498 0.91 RAB9A (0.67) RAB9AMAPTL3MBTL1THRBCASP3

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-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