SCHEMBL97245

SCHEMBL97245

CCCCCCCCCCCCc1ccc2c(c1)C(C)=CC(C)(C)N2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.69
▸ KDM4E B2RXH2 6/20 0.69
▸ HPGD P15428 6/20 0.69
▸ GAA P10253 1/20 0.69
▸ MAPT P10636 3/20 0.67
▸ TDP1 Q9NUW8 3/20 0.67
▸ MEN1 O00255 3/20 0.67
▸ KMT2A Q03164 3/20 0.67
▸ L3MBTL1 Q9Y468 2/20 0.67
▸ MAPK1 P28482 1/20 0.67
▸ HSD17B10 Q99714 5/20 0.55
▸ CYP3A4 P08684 3/20 0.54
▸ CYP1A2 P05177 2/20 0.54
▸ CYP2D6 P10635 2/20 0.54
▸ CYP2C9 P11712 2/20 0.54
▸ CYP2C19 P33261 2/20 0.54
▸ LMNA P02545 2/20 0.53
▸ ALOX15 P16050 1/20 0.53
▸ ALOX12 P18054 1/20 0.53
▸ HIF1A Q16665 1/20 0.53

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
SCHEMBL7044150 1.00 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL7073745 1.00 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL7071614 1.00 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL7069498 1.00 ALDH1A1 (0.69) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL1263211 0.99 ALDH1A1 (0.71) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL7071108 0.94 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL95135 0.94 ALDH1A1 (0.61) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL7073326 0.88 ALDH1A1 (0.77) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL28118940 0.83 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDGAAMAPT
SCHEMBL11399430 0.80 MAPT (0.55) ALDH1A1KDM4EHPGDGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113402790-B Composition based on butyl rubber and nitrile rubber, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2022-09-20 — — CN claimed
CN-113402791-B Nitrile rubber-based vulcanized composition, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2022-09-20 — — CN claimed
CN-114426716-A Composition for preparing composite hydrogenated nitrile rubber, application of composition, composite hydrogenated nitrile rubber and preparation method of composite hydrogenated nitrile rubber 中国石油化工股份有限公司 2022-05-03 — — CN claimed
CN-114426717-A Vulcanized composition for preparing hydrogenated nitrile rubber and application thereof, and hydrogenated nitrile rubber and preparation method and application thereof 中国石油化工股份有限公司 2022-05-03 — — CN claimed
CN-113493579-A Composition for rubber sealing material, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2021-10-12 — — CN claimed
CN-113493577-A Vulcanized composition based on nitrile rubber and butadiene rubber, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2021-10-12 — — CN claimed
CN-113493578-A Rubber composition based on ethylene propylene diene monomer and nitrile rubber, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2021-10-12 — — CN claimed
CN-113493580-A Styrene butadiene rubber-based rubber composition, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2021-10-12 — — CN claimed
CN-113402791-A Nitrile rubber-based vulcanized composition, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2021-09-17 — — CN claimed
CN-113402790-A Composition based on butyl rubber and nitrile rubber, vulcanized rubber, and preparation method and application thereof 中国石油化工股份有限公司 2021-09-17 — — CN claimed
EP-0121947-B1 LAYERED PRODUCT WITH FLEXIBLE REGIONS FOR REDUCING NOISE CAUSED BY AN OBJECT AND/OR IN THE AIR FROM ACOUSTICALLY EXCITED SURFACES Pelzer, Helmut (DE) 1989-08-30 — — EP claimed
US-4843128-A CURED BLEND OF HIGH AND LOW MOLECULAR WEIGHT EPDM TER, UNSATURATED RUBBER, AND QUINOLINE ANTIDEGRADANT; PRECISION MOLDED PARTS UNIROYAL CHEMICAL COMPANY, INC. (US) 1989-06-27 — — US claimed
US-4797511-A SYNERGISTIC UNIROYAL CHEMICAL COMPANY, INC. (US) 1989-01-10 — — US claimed
EP-0108714-A1 Dibenzodioxaphosphepine and dioxaphosphocine processing stabilizers CIBA-GEIGY AG (CH) 1984-05-16 — — EP claimed
EP-0000790-B1 PROCESS FOR THE PRODUCTION OF PHOSPHAZENE POLYMERS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1984-01-04 — — EP claimed
US-4187205-A Radiation-sensitive composition NIPPON TELEGRAPH AND TELEPHONE PUBLIC CORPORATION (JP) 1980-02-05 — — US claimed
EP-0001748-A1 A process for improving the physical properties of phosphazene ester polymers by chemical modification with amines THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-05-16 — — EP claimed
EP-0000790-A1 Process for the production of phosphazene polymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1979-02-21 — — EP claimed
US-4130547-A Chemical modification of poly(bis-aryloxyphosphazene) with amines THE FIRESTONE TIRE & RUBBER COMPANY (US) 1978-12-19 — — US claimed
US-4129529-A Process for the production of phosphazene polymers THE FIRESTONE TIRE & RUBBER COMPANY (US) 1978-12-12 — — US claimed
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