SCHEMBL8205668

SCHEMBL8205668

O=C1C(O)=CC(=O)c2c1ccc1ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.51
▸ NSD2 O96028 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 1/20 0.51
▸ HKDC1 Q2TB90 1/20 0.51
▸ KMT2A Q03164 4/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ USP2 O75604 2/20 0.47
▸ HIF1A Q16665 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ MAPT P10636 4/20 0.45

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
SCHEMBL30222271 0.86 DNMT1 (0.56) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL9350950 0.86 NSD2 (0.59) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL9350222 0.86 DNMT1 (0.56) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL11062392 0.79 DNMT1 (0.47) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL19230420 0.77 DNMT1 (0.73) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL7122517 0.77 DNMT1 (0.73) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL12236188 0.77 DNMT1 (0.67) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL30362207 0.77 DNMT1 (0.67) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL9900718 0.75 DNMT1 (0.70) DNMT1NSD2OPRM1OPRD1HKDC1
SCHEMBL19230419 0.75 DNMT1 (0.83) DNMT1NSD2OPRM1OPRD1HKDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 — — US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 — — US disclosed
EP-0320227-B1 Method of preventing polymer-scale formation SHINETSU CHEMICAL CO (JP) 1994-09-07 — — EP disclosed
US-4933399-A COATING INSIDE OF VESSEL WITH A CATIONIC DYE, DRYING, COATING WITH AN ANIONIC OR AMPHOTERIC POLYMER OR A HYDROXYL-CONTAINING COMPOUND IN A SOLVENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 1990-06-12 — — US disclosed
EP-0320227-A2 Method of preventing polymer-scale formation Shin-Etsu Chemical Co., Ltd. (JP) 1989-06-14 — — EP disclosed
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