SCHEMBL9637386

SCHEMBL9637386

CCCCOc1cnc(-c2ccc(CCCC)cc2)nc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.62
NPC1 O15118 5/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
KDM4E B2RXH2 4/20 0.62
HSD17B10 Q99714 2/20 0.62
MAPT P10636 4/20 0.59
ALDH1A1 P00352 4/20 0.59
MEN1 O00255 2/20 0.59
USP2 O75604 2/20 0.59
HPGD P15428 2/20 0.59
KMT2A Q03164 2/20 0.59
GAA P10253 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.48
RARB P10826 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
CYP2C9 P11712 4/20 0.48
CYP2C19 P33261 4/20 0.48

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
SCHEMBL9639105 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636298 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636162 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636309 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636353 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636224 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636080 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636293 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9636336 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL9637690 0.94 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10

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-0306917-B1 A NEMATIC LIQUID CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1992-06-17 EP disclosed
US-4917818-A STEEP VOLTAGE TRANSMITTANCE USED IN WATCHES, ELECTRONIC CALCULATORS CHISSO CORPORATION (JP) 1990-04-17 US disclosed
EP-0306917-A2 A nematic liquid crystal composition CHISSO CORPORATION (JP) 1989-03-15 EP disclosed