SCHEMBL8044573

SCHEMBL8044573

CCCCCCCCCCOc1cnc(-c2ccc(/C=C/CCCC(C)O)cc2)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.41
NPC1 O15118 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPT P10636 2/20 0.38
RARB P10826 4/20 0.38
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR1B P28222 1/20 0.36
HTR2B P41595 1/20 0.36
ASAH2 Q9NR71 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TNNC1 P63316 1/20 0.35
ACACB O00763 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL8049555 1.00 RAB9A (0.41) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8052519 1.00 RAB9A (0.41) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8044578 1.00 RAB9A (0.41) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8052513 1.00 RAB9A (0.41) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8049551 1.00 RAB9A (0.41) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8046950 0.90 TNNC1 (0.41) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8046946 0.90 TNNC1 (0.41) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8052715 0.89 RAB9A (0.49) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8052710 0.89 RAB9A (0.49) RAB9ANPC1SMN1; SMN2KDM4EHSD17B10
SCHEMBL8052734 0.88 RAB9A (0.41) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0643119-B1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-6030546-A FERROELECTRIC PHASE; LOW VISCOSITY;, THERMOSENSITIVITY OVER A BROAD AND EXHIBITS A LARGE TILT ANGLE AND A HIGH-SPEED RESPONSE PROPERTY;CHEMICAL INTERMEDIATES FOR PESTICIDES, DRUGS AND LIQUID CRYSTALS; BORIDING AND HYDROLYSIS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-29 US disclosed
EP-0667384-B1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-12-16 EP disclosed
US-5707547-A CONTAINING FLUORINATED BENZENE OR NAPHTHALENE RINGS AND/OR NITROGEN CONTAINING HETEROCYCLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-01-13 US disclosed
EP-0667384-A1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-08-16 EP disclosed
EP-0643119-A1 Trans-olefin compounds, method for production thereof, liquid crystal composition containing the same as active ingredient, and liquid crystal element using said composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-03-15 EP disclosed