SCHEMBL13245893

SCHEMBL13245893

Cc1cc(-n2n3c4ccccc4n23)c(O)c(C(C)(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ CA2 P00918 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ POLB P06746 1/20 0.53
▸ TYR P14679 1/20 0.53
▸ HSPA5 P11021 1/20 0.45
▸ CYP2C9 P11712 3/20 0.44
▸ CYP2C19 P33261 3/20 0.44
▸ HIF1A Q16665 2/20 0.44
▸ TSHR P16473 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ PTGS1 P23219 2/20 0.38
▸ PTGS2 P35354 2/20 0.38
▸ CA1 P00915 1/20 0.37
▸ F2R P25116 4/20 0.37
▸ MAPT P10636 2/20 0.37
▸ GABRA1 P14867 1/20 0.37
▸ GABRB2 P47870 1/20 0.37

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
SCHEMBL12733203 0.87 HSPA5 (0.63) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL13652813 0.85 ESR1 (0.38) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL13223648 0.85 SMN1; SMN2 (0.36) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL9002281 0.84 TSHR (0.46) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL9002863 0.84 SMN1; SMN2 (0.46) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL12733208 0.80 HSPA5 (0.54) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL12733192 0.80 HSPA5 (0.57) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL13223584 0.80 HSPA5 (0.50) SMN1; SMN2ALDH1A1HSPA5CYP2C9CYP2C19
SCHEMBL10453379 0.80 CA2 (0.57) SMN1; SMN2CA2ALDH1A1POLBTYR
SCHEMBL14566258 0.80 CA2 (0.53) CA2ALDH1A1TSHRTDP1PTGS1

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
US-8298455-B2 Alignment material composition and alignment layer AU OPTRONICS CORPORATION (TW) 2012-10-30 — — US disclosed
US-20100213423-A1 ALIGNMENT MATERIAL COMPOSITION AND ALIGNMENT LAYER AU OPTRONICS CORPORATION (TW) 2010-08-26 — — US disclosed
US-7534539-B2 Electrophotographic photoreceptor and image forming apparatus having the same SHARP KABUSHIKI KAISHA (JP) 2009-05-19 — — US disclosed
EP-1857477-A1 (METH)ACRYLATE COMPOUND, PROCESS FOR PRODUCTION OF THE COMPOUND, (METH)ACRYLATE COPOLYMER, PROCESS FOR PRODUCTION OF THE COPOLYMER, AND SOFT INTRAOCULAR LENS HOYA CORPORATION (JP) 2007-11-21 — — EP disclosed
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