SCHEMBL27769260

SCHEMBL27769260

CNc1cccc2cc(N)ccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.53
▸ ALDH1A1 P00352 4/20 0.43
▸ HSD17B10 Q99714 3/20 0.43
▸ CYP3A4 P08684 3/20 0.43
▸ CASP1 P29466 3/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ HBB P68871 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ HTR6 P50406 1/20 0.41
▸ EGFR P00533 2/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40
▸ CASP6 P55212 1/20 0.40
▸ KEAP1 Q14145 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ TP53 P04637 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36

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
SCHEMBL28645009 0.81 PLAU (0.53) PLAUALDH1A1HSD17B10CYP3A4CASP1
SCHEMBL16194432 0.78 CYP1A2 (0.59) ALDH1A1HSD17B10TDP1CASP6KEAP1
SCHEMBL27937834 0.77 CYP1A2 (0.43) TDP1EGFRCASP6KEAP1MAPT
SCHEMBL27937821 0.77 FADS1 (0.46) ALDH1A1CASP6KEAP1KDM4ESMN1; SMN2
SCHEMBL27937859 0.77 CASP6 (0.40) ALDH1A1HSD17B10CYP3A4TDP1ALOX15
SCHEMBL27937958 0.77 TLR8 (0.45) CASP6GAAMEN1KMT2ACYP1A2
SCHEMBL49308 0.74 KEAP1 (0.61) ALDH1A1HSD17B10CYP3A4TDP1ALOX15
SCHEMBL20038678 0.74 CASP6 (0.41) ALDH1A1HSD17B10CYP3A4TDP1EGFR
SCHEMBL27937816 0.74 HTR6 (0.47) ALDH1A1HSD17B10CYP3A4TDP1ALOX15
SCHEMBL27937950 0.74 CYP1A2 (0.50) ALDH1A1CASP6KEAP1KDM4EMAPT

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
CN-104969123-B Aligning agent for liquid crystal, liquid crystal orientation film and liquid crystal display element 日产化学工业株式会社 2019-03-15 — — CN disclosed
CN-105492535-B Composition for forming cured film, alignment material, and phase difference material 日产化学工业株式会社 2018-03-16 — — CN disclosed
CN-101633621-A Liquid crystal orientation agent, liquid crystal orientation film and liquid crystal display element using liquid crystal orientation agent NISSAN CHEMICAL IND LTD 2010-01-27 — — CN disclosed
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