SCHEMBL9429367

SCHEMBL9429367

CCCCCCCCCCc1cnc(-c2ccc(OC(CCCCCC)C(F)(F)F)cc2)nc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.51
RAB9A P51151 7/20 0.48
MAPT P10636 5/20 0.48
SMN1; SMN2 Q16637 5/20 0.48
KDM4E B2RXH2 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MEN1 O00255 1/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
HPGD P15428 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.43
CASP3 P42574 1/20 0.43
SENP8 Q96LD8 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
NPC1 O15118 5/20 0.41
STAT3 P40763 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL8757828 0.85 RAB9A (0.50) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL13127087 0.83 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9238218 0.83 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9239568 0.83 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9239239 0.83 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9241347 0.83 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9240549 0.83 RARB (0.55) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9061888 0.83 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9061243 0.83 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2KDM4E
SCHEMBL9061348 0.83 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2229174-A None JP disclosed
US-5290478-A Nitrile containing naphthylene compound SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-01 US disclosed
EP-0385692-B1 OPTCALLY ACTIVE COMPOUNDS SANYO CHEMICAL INDUSTRIES LTD. (JP) 1993-10-06 EP disclosed
US-5160662-A Improved response times SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1992-11-03 US disclosed
JP-H02229174-A OPTICALLY ACTIVE COMPOUND SANYO CHEM IND LTD 1990-09-11 JP disclosed
EP-0385692-A2 Optcally active compounds SANYO CHEMICAL INDUSTRIES LTD. (JP) 1990-09-05 EP disclosed