SCHEMBL9620792

SCHEMBL9620792

CCCCCc1ccc(-c2ccc(OCC)cc2)nc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 1.00
MAPT P10636 6/20 1.00
L3MBTL1 Q9Y468 3/20 1.00
CASP3 P42574 2/20 0.79
SENP8 Q96LD8 2/20 0.79
SENP7 Q9BQF6 2/20 0.79
SENP6 Q9GZR1 2/20 0.79
SMN1; SMN2 Q16637 7/20 0.68
NPC1 O15118 6/20 0.68
STAT3 P40763 1/20 0.68
ATM Q13315 1/20 0.68
NFKB1 P19838 2/20 0.63
NFKB2 Q00653 2/20 0.63
RELA Q04206 2/20 0.63
MAPK1 P28482 1/20 0.62
THRB P10828 2/20 0.62
KDM4E B2RXH2 4/20 0.56
ALDH1A1 P00352 4/20 0.56
HPGD P15428 4/20 0.56
HTT P42858 1/20 0.52

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
SCHEMBL9621212 0.99 RAB9A (0.97) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL9620849 0.99 RAB9A (0.97) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL9620812 0.99 RAB9A (0.97) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL10552803 0.97 RAB9A (0.94) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL10556512 0.97 RAB9A (0.94) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL10554948 0.97 RAB9A (0.94) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL10559024 0.96 RAB9A (0.92) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL10556382 0.96 RAB9A (0.92) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL10558286 0.96 RAB9A (0.92) RAB9AMAPTL3MBTL1CASP3SENP8
SCHEMBL10559171 0.96 RAB9A (0.92) RAB9AMAPTL3MBTL1CASP3SENP8

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