SCHEMBL8046946

SCHEMBL8046946

CCCCCCCC/C=C/c1ccc(-c2ncc(/C=C/CCCC(C)O)cn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.41
RARB P10826 1/20 0.39
RAB9A P51151 5/20 0.39
KDM4E B2RXH2 4/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
HSD17B10 Q99714 2/20 0.39
MEN1 O00255 1/20 0.39
USP2 O75604 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 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
SCHEMBL8046950 1.00 TNNC1 (0.41) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8049551 0.90 RAB9A (0.41) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8044578 0.90 RAB9A (0.41) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8044573 0.90 RAB9A (0.41) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8052513 0.90 RAB9A (0.41) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8571151 0.90 RARB (0.51) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8052519 0.90 RAB9A (0.41) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8668785 0.90 RARB (0.51) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8049555 0.90 RAB9A (0.41) TNNC1RARBRAB9AKDM4ESMN1; SMN2
SCHEMBL8565168 0.89 ALDH1A1 (0.52) TNNC1RARBRAB9AKDM4ESMN1; SMN2

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 4 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
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-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