SCHEMBL70587

SCHEMBL70587

Cc1cc(C)c(O)c(Sc2cc(C)cc(C)c2O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.50
▸ MAPT P10636 4/20 0.50
▸ LMNA P02545 3/20 0.50
▸ GAA P10253 3/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ ALOX15 P16050 3/20 0.48
▸ TP53 P04637 3/20 0.48
▸ HPGD P15428 2/20 0.48
▸ ALOX12 P18054 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ CA2 P00918 2/20 0.42
▸ SELL P14151 1/20 0.42
▸ SELP P16109 1/20 0.42
▸ SELE P16581 1/20 0.42
▸ CA1 P00915 1/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ TSHR P16473 2/20 0.38

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
SCHEMBL18931270 0.86 ALDH1A1 (0.46) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL6846199 0.85 ALDH1A1 (0.50) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL10299829 0.84 SMN1; SMN2 (0.59) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL8923091 0.80 CYP3A4 (0.44) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL36529 0.78 ALDH1A1 (0.65) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL27800318 0.78 ALDH1A1 (0.65) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL19621130 0.77 EGFR (0.42) MAPTLMNAGAAMEN1KMT2A
SCHEMBL11438979 0.76 CYP3A4 (0.61) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL10814346 0.76 CYP3A4 (0.39) ALDH1A1MAPTLMNAGAAKDM4E
SCHEMBL30519953 0.76 CYP3A4 (0.61) ALDH1A1MAPTLMNAGAAKDM4E

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 74 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016161033-A1 METHODS FOR MAKING OLIGOMERIC ACIDS AND ROSIN OIL FROM CRUDE TALL OIL GEORGIA-PACIFIC CHEMICALS LLC (US) 2016-10-06 — — WO claimed
EP-3064484-B1 PREPARATION OF 2,2'-BIARYLS IN THE PRESENCE OF MOLYBDENUM (V) CHLORIDE EVONIK DEGUSSA GMBH (DE) 2018-06-20 — — EP disclosed
US-9834511-B2 Organodiaryl selenoxides and process for preparation thereof EVONIK DEGUSSA GMBH (DE) 2017-12-05 — — US disclosed
US-9765023-B2 Complexes of diphenyl selenoxides, use thereof and catalysis methods EVONIK DEGUSSA GMBH (DE) 2017-09-19 — — US disclosed
EP-3178825-A1 HETEROCYCLIC SELENA PHOSPHITES AND METHOD FOR THE PRODUCTION THEREOF Evonik Degussa GmbH (DE) 2017-06-14 — — EP disclosed
EP-3178826-A1 HETEROCYCLIC SELENA MONOPHOSPHITES SECURED ON A HYDROXYL GROUP AND METHOD FOR THE PRODUCTION THEREOF Evonik Degussa GmbH (DE) 2017-06-14 — — EP disclosed
EP-3178827-A1 HETEROCYCLIC SELENA BIPHOSPHITES AND METHOD FOR THE PRODUCTION THEREOF Evonik Degussa GmbH (DE) 2017-06-14 — — EP disclosed
EP-3178830-A1 COMPLEXES OF DIPHENYLSELENONES, THEIR USE AND CATALYTIC PROCESS Evonik Degussa GmbH (DE) 2017-06-14 — — EP disclosed
EP-3178829-A1 ORGANODIARYL SELENIUM OXIDES AND METHOD FOR THE PRODUCTION THEREOF Evonik Degussa GmbH (DE) 2017-06-14 — — EP disclosed
EP-3178828-A1 HETEROCYCLIC SELENA PHOSPHITES AND METHOD FOR THE PRODUCTION THEREOF Evonik Degussa GmbH (DE) 2017-06-14 — — EP disclosed
US-6232421-B1 USING COORDINATION ORGANOMETALLIC COMPLEX CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-05-15 — — US disclosed
EP-1046654-A1 Olefin polymerization catalysts and olefin polymer production methods using said olefin polymerization catalysts JSR Corporation (JP) 2000-10-25 — — EP disclosed
EP-0457334-B1 Carbonates of acetylenic alcohols NIPPON PAINT CO LTD (JP) 1994-08-10 — — EP disclosed
US-5258542-A Carbonates of acetylenic alcohols NIPPON PAINT CO., LTD. (JP) 1993-11-02 — — US disclosed
US-5194653-A Useful in making heat resistant liquid crystalline polymers NIPPON PAINT COMPANY, LIMITED (JP) 1993-03-16 — — US disclosed
EP-0269569-B1 ESTERIFICATION PROCESS WITH CALCIUM HYDROXYBENZYL PHOSPHONATE-PHENOL SULFIDE CATALYST SYSTEM CIBA-GEIGY AG (CH) 1992-05-13 — — EP disclosed
EP-0457334-A1 Carbonates of acetylenic alcohols NIPPON PAINT CO., LTD. (JP) 1991-11-21 — — EP disclosed
US-4287366-A BY OXIDATION OF THE CORRESPONDING SULFIDE OR SULFOXIDE WITH HYDROGEN PEROXIDE IN THE PRESENCE OF AN ALKALI METAL HYDROXIDE MITSUI TOATSU CHEMICALS, INC. (JP) 1981-09-01 — — US disclosed
US-4275240-A OXIDATION OF 2,2'-BISPHENOL SULFIDES IN A SOLVENT MITSUI TOATSU CHEMICALS, INC. (JP) 1981-06-23 — — US disclosed
US-3991139-A NORBORNENE DERIVATIVES, PHENOLS, ESTER THIOETHERS SHOWA DENKO KABUSHIKI KAISHA (JA) 1976-11-09 — — US disclosed
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