SCHEMBL27720997

SCHEMBL27720997

Cc1cc(CC2CCCCC2)ccc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.53
▸ ESR2 Q92731 5/20 0.53
▸ ERCC1 P07992 1/20 0.42
▸ ERCC4 Q92889 1/20 0.42
▸ OPRK1 P41145 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ NUDT1 P36639 1/20 0.40
▸ BACE1 P56817 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ THRA P10827 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ AR P10275 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ PDE5A O76074 1/20 0.38
▸ RARB P10826 1/20 0.37
▸ PDE10A Q9Y233 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
SCHEMBL16191256 0.84 KCNH2 (0.42) OPRK1NPC1RAB9ALTA4H
SCHEMBL1291889 0.82 ERCC1 (0.54) ERCC1ERCC4GAABACE1
SCHEMBL17748785 0.81 CEL (0.41) OPRK1NPC1THRATHRBRAB9A
SCHEMBL30921631 0.81 CEL (0.41) OPRK1NPC1THRATHRBRAB9A
SCHEMBL28182371 0.80 MAOA (0.42) ESR1ESR2OPRK1GAA
SCHEMBL22990868 0.79 SLC6A2 (0.47) LTA4H
SCHEMBL13086023 0.79 NUDT1 (0.43) ERCC1ERCC4OPRK1GAAPKM
SCHEMBL12239177 0.79 CA2 (0.46) ERCC1ERCC4NPC1GAANUDT1
SCHEMBL5191935 0.79 ERCC1 (0.40) ERCC1ERCC4NUDT1BACE1TDP1
SCHEMBL28717773 0.77 OPRK1 (0.36) OPRK1NPC1GAAPKMHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101305030-B Polyfunctional poly(arylene ether) method GEN ELECTRIC 2011-07-13 — — CN claimed
CN-101326215-A Poly (arylene ether) copolymer GEN ELECTRIC (US) 2008-12-17 — — CN claimed
CN-101305030-A Polyfunctional poly(arylene ether) method GEN ELECTRIC (US) 2008-11-12 — — CN claimed
CN-105283482-B Thermoplastic polyurethanes and related methods and articles 沙特基础全球技术有限公司 2017-12-08 — — CN disclosed
CN-105452318-B Rigid foam and correlated product 沙特基础全球技术有限公司 2017-11-28 — — CN disclosed
CN-105531323-A Composition and article comprising thermoplastic polyurethane and particulate engineering polymer SABIC INNOVATIVE PLASTICS IP BV 2016-04-27 — — CN disclosed
CN-105473656-A Poly(phenylene ether) /epoxy homogeneous solid and powder coating composition incorporating same SABIC INNOVATIVE PLASTICS IP BV 2016-04-06 — — CN disclosed
CN-105452318-A Rigid foam and associated article SABIC INNOVATIVE PLASTICS IP BV 2016-03-30 — — CN disclosed
CN-105283482-A Thermoplastic polyurethanes and related methods and articles SABIC GLOBAL TECHNOLOGIES BV 2016-01-27 — — CN disclosed
CN-102762633-B Methods for the preparation of a poly(arylene ether) polysiloxane multiblock copolymer SABIC INNOVATIVE PLASTICS IP 2014-06-25 — — CN disclosed
CN-102762633-A Methods for the preparation of a poly(arylene ether) polysiloxane multiblock copolymer SABIC INNOVATIVE PLASTICS IP 2012-10-31 — — CN disclosed
CN-101326215-B Poly (arylene ether) copolymer SABIC INNOVATIVE PLASTICS IP 2012-05-23 — — CN disclosed
CN-101305030-B Polyfunctional poly(arylene ether) method GEN ELECTRIC 2011-07-13 — — CN disclosed
CN-101326215-A Poly (arylene ether) copolymer GEN ELECTRIC (US) 2008-12-17 — — CN disclosed
CN-101305030-A Polyfunctional poly(arylene ether) method GEN ELECTRIC (US) 2008-11-12 — — CN disclosed
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