SCHEMBL17127066

SCHEMBL17127066

C=Cn1c2ccc3ccccc3c2c2c3ccccc3ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 4/20 0.44
▸ ALDH1A1 P00352 3/20 0.44
▸ TSHR P16473 3/20 0.44
▸ CYP2A6 P11509 3/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ HPRT1 P00492 1/20 0.41
▸ HPGD P15428 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ CYP1A2 P05177 3/20 0.38
▸ CYP1B1 Q16678 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ MAPT P10636 1/20 0.35
▸ PTPN22 Q9Y2R2 1/20 0.34

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
SCHEMBL24427120 0.77 GAA (0.42) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL36244 0.75 GPR3 (0.46) HSD17B10ALDH1A1TSHRTDP1HPGD
SCHEMBL29352713 0.75 GPR3 (0.46) HSD17B10ALDH1A1TSHRTDP1HPGD
SCHEMBL17224383 0.75 GPR3 (0.46) HSD17B10ALDH1A1TSHRTDP1HPGD
SCHEMBL24404708 0.74 HPGD (0.37) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL30772964 0.74 GPR3 (0.52) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL19831358 0.74 HSD17B10 (0.48) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL10023491 0.74 GPR3 (0.52) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL19545508 0.74 ALDH1A1 (0.48) HSD17B10ALDH1A1TSHRCYP2A6TDP1
SCHEMBL17127114 0.73 MEN1 (0.40) HSD17B10ALDH1A1TSHRCYP2A6TDP1

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-9847490-B2 Copolymer, material for organic electronic element, material for organic electroluminescent element, and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2017-12-19 — — US disclosed
US-9847490-B2 Copolymer, material for organic electronic element, material for organic electroluminescent element, and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2017-12-19 — — US disclosed
US-20150280131-A1 COPOLYMER, MATERIAL FOR ORGANIC ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-10-01 — — US disclosed
US-20150280131-A1 COPOLYMER, MATERIAL FOR ORGANIC ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-10-01 — — US disclosed
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