SCHEMBL2997923

SCHEMBL2997923

COC(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 10/20 0.52
▸ ESR2 Q92731 10/20 0.52
▸ PDCD1 Q15116 1/20 0.52
▸ CD274 Q9NZQ7 1/20 0.52
▸ IDO1 P14902 1/20 0.48
▸ TDO2 P48775 1/20 0.48
▸ LMNA P02545 2/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ ALOX15 P16050 2/20 0.46
▸ CYP2C9 P11712 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ PGR P06401 1/20 0.46
▸ CHRM2 P08172 1/20 0.46
▸ ADORA3 P0DMS8 1/20 0.46
▸ AR P10275 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CHRM1 P11229 1/20 0.46
▸ DRD1 P21728 1/20 0.46

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
SCHEMBL11106826 0.89 IDO1 (0.47) ESR1ESR2PDCD1CD274IDO1
Methacrylic Acid SCHEMBL9703416 0.82 ESR1 (0.41) ESR1ESR2PDCD1CD274IDO1
Acrylic Acid SCHEMBL9704013 0.82 ALDH5A1 (0.41) ESR1ESR2PDCD1CD274IDO1
SCHEMBL8732821 0.81 GRIN1 (0.38) ESR1ESR2PDCD1CD274IDO1
SCHEMBL5142966 0.79 ESR1 (0.52) ESR1ESR2PDCD1CD274LMNA
SCHEMBL28427166 0.78 IDO1 (0.52) ESR1ESR2PDCD1CD274IDO1
SCHEMBL21769395 0.77 ESR1 (0.50) ESR1ESR2PDCD1CD274LMNA
SCHEMBL303515 0.77 ESR1 (0.56) ESR1ESR2PDCD1CD274LMNA
SCHEMBL23296602 0.76 IDO1 (0.46) IDO1TDO2LMNACYP1A2CHRM2
SCHEMBL791847 0.76 MLKL (0.49) MAPTTDP1ALDH1A1CA1CA2

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
EP-0222059-B1 IMPROVED RADIATION-HARDENABLE DILUENTS HENKEL CORPORATION (a Delaware corp.) (US) 1992-07-08 — — EP claimed
US-8481238-B2 Electrophotographic photoreceptors, electrophotographic photoreceptor cartridge, and image-forming apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2013-07-09 — — US disclosed
US-20100183332-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTORS, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE-FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2010-07-22 — — US disclosed
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