SCHEMBL9141663

SCHEMBL9141663

CCCC(C)c1ccc(Oc2ccc(N)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TDP1 Q9NUW8 5/20 0.50
TSHR P16473 2/20 0.50
CYP3A4 P08684 1/20 0.50
TEAD4 Q15561 1/20 0.47
MAPT P10636 5/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
MAOA P21397 2/20 0.44
MAPK1 P28482 2/20 0.43
HPGD P15428 1/20 0.43
MAOB P27338 1/20 0.42
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
GAA P10253 1/20 0.41
GFER P55789 1/20 0.41
KMT2A Q03164 1/20 0.41
NLRP1 Q9C000 1/20 0.41

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
SCHEMBL20758394 0.89 GRIA4 (0.42) ALDH1A1TDP1TSHRCYP3A4MAPT
SCHEMBL2407454 0.89 GRIA4 (0.42) ALDH1A1TDP1TSHRCYP3A4MAPT
SCHEMBL18745964 0.85 ALDH1A1 (0.49) ALDH1A1TDP1TSHRMAPTNPC1
SCHEMBL6558453 0.85 ALDH1A1 (0.54) ALDH1A1TDP1TSHRCYP3A4TEAD4
SCHEMBL1857384 0.84 ALDH1A1 (0.52) ALDH1A1TDP1TSHRCYP3A4TEAD4
SCHEMBL12112121 0.84 ALDH1A1 (0.52) ALDH1A1TDP1TSHRCYP3A4TEAD4
SCHEMBL19736611 0.84 LTA4H (0.52) ALDH1A1TSHRSMN1; SMN2
SCHEMBL22808173 0.83 GRIA4 (0.50) ALDH1A1TDP1CYP3A4MAPTNPC1
SCHEMBL1857360 0.83 ALDH1A1 (0.47) ALDH1A1TDP1TSHRCYP3A4TEAD4
SCHEMBL27629258 0.82 FFAR1 (0.43) MAPTMAOAMAOBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5447759-A Liquid crystal alignment film and liquid crystal display element CHISSO CORPORATION (JP) 1995-09-05 US disclosed