SCHEMBL9497797

SCHEMBL9497797

C=CCn1cncc1C=C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
Hydrochloric Acid SCHEMBL9443719 0.98 ADORA2B (0.32) ADORA2BCYP11B1CYP11B2
SCHEMBL9038632 0.84 CYP11B1 (0.46) ADORA2BCYP11B1CYP11B2CYP1A2CYP3A4
SCHEMBL28858344 0.81
SCHEMBL27364397 0.77
SCHEMBL2028966 0.76 ESR1 (0.33) ADORA2BCYP11B1CYP11B2
Iodide SCHEMBL27303018 0.75 CYP19A1 (0.41) ADORA2BCYP11B1CYP11B2CYP1A2CYP3A4
SCHEMBL5779690 0.75
SCHEMBL28470189 0.75
SCHEMBL2053090 0.73 AVPR2 (0.32) ADORA2B
SCHEMBL2033650 0.73 ALDH1A1 (0.37) CYP1A2CYP3A4CYP2D6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118431667-B Lithium ion battery diaphragm and preparation method thereof 湖南博盛新能源技术有限公司 2024-09-13 CN claimed
CN-118431667-A Lithium ion battery diaphragm and preparation method thereof 湖南博盛新能源技术有限公司 2024-08-02 CN claimed
EP-0346465-B1 1-CARBOXY-1-VYNILOXYIMINOAMINOTHIAZOLE CEPHALOSPORING DERIVATIVES AND PROCESS FOR THEIR PREPARATION BANYU PHARMACEUTICAL CO., LTD. (JP) 1993-08-11 EP claimed
CN-118431667-B Lithium ion battery diaphragm and preparation method thereof 湖南博盛新能源技术有限公司 2024-09-13 CN disclosed
CN-118431667-B Lithium ion battery diaphragm and preparation method thereof 湖南博盛新能源技术有限公司 2024-09-13 CN disclosed
CN-118431667-A Lithium ion battery diaphragm and preparation method thereof 湖南博盛新能源技术有限公司 2024-08-02 CN disclosed
CN-118431667-A Lithium ion battery diaphragm and preparation method thereof 湖南博盛新能源技术有限公司 2024-08-02 CN disclosed
US-5239002-A Blend of polyarylene sulfide and nitrogen heterocyclic polymer; wire coatings PHILLIPS PETROLEUM COMPANY (US) 1993-08-24 US disclosed
EP-0541548-A1 POLYMERS FOR PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY (US) 1993-05-19 EP disclosed
EP-0471336-A2 Polymeric adhesive and anti-corrosion agents PHILLIPS PETROLEUM COMPANY (US) 1992-02-19 EP disclosed
US-5077187-A Controlling migration of filter dyes EASTMAN KODAK COMPANY (US) 1991-12-31 US disclosed
WO-1991007448-A1 POLYMERS FOR PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY (US) 1991-05-30 WO disclosed
WO-1991007449-A1 POLYMERS FOR PHOTOGRAPHIC ELEMENTS EASTMAN KODAK COMPANY (US) 1991-05-30 WO disclosed
US-5006450-A Amine acid addition salt groups, for controlling fitter dye migration EASTMAN KODAK COMPANY (US) 1991-04-09 US disclosed