SCHEMBL8037006

SCHEMBL8037006

C=CCc1ccc(-c2ccc(-c3ccc(/C=C/CCCC(C)O)nc3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGS2 P35354 1/20 0.32
CNR2 P34972 2/20 0.31
CNR1 P21554 1/20 0.31
TP53 P04637 2/20 0.31
TSHR P16473 2/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
ALOX12 P18054 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL8037007 1.00 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA
SCHEMBL8054382 1.00 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA
SCHEMBL8054381 1.00 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA
SCHEMBL8048449 0.89 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA
SCHEMBL8048452 0.89 ALDH1A1 (0.34) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA
SCHEMBL7558274 0.88 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2TP53TSHRCYP3A4
SCHEMBL7558278 0.88 ALDH1A1 (0.31) ALDH1A1SMN1; SMN2TP53TSHRCYP3A4
SCHEMBL8047619 0.88 CNR2 (0.33) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA
SCHEMBL8047775 0.88 CNR2 (0.33) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA
SCHEMBL8047614 0.88 CNR2 (0.33) ALDH1A1SMN1; SMN2KDM4EMEN1LMNA

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