SCHEMBL8156871

SCHEMBL8156871

C=CCc1ccccc1N=C=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.42
GABRA1 P14867 3/20 0.40
GABRB2 P47870 3/20 0.40
GAA P10253 2/20 0.32
KDM4E B2RXH2 4/20 0.32
ALDH1A1 P00352 3/20 0.32
KMT2A Q03164 4/20 0.32
MAPT P10636 3/20 0.32
MEN1 O00255 3/20 0.32
LMNA P02545 3/20 0.32
HTT P42858 2/20 0.32
ALOX12 P18054 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
AURKA O14965 1/20 0.31
DAPK3 O43293 1/20 0.31
MAP4K4 O95819 1/20 0.31
RET P07949 1/20 0.31
IGF1R P08069 1/20 0.31
MET P08581 1/20 0.31
PIM1 P11309 1/20 0.31

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
SCHEMBL2532569 0.85 GABRA1 (0.41) GABRA1GABRB2GAAKDM4EALDH1A1
SCHEMBL9325896 0.84 GABRA1 (0.49) CYP3A4GABRA1GABRB2GAAKDM4E
SCHEMBL17063571 0.83 GABRA1 (0.40) GABRA1GABRB2GAAKDM4EALDH1A1
SCHEMBL10788015 0.82 ICAM1 (0.40) GAAKDM4EALDH1A1LMNA
SCHEMBL10511404 0.82 GABRA1 (0.41) CYP3A4GABRA1GABRB2
SCHEMBL28081941 0.81 ALDH1A1 (0.43) CYP3A4GABRA1GABRB2GAAKDM4E
SCHEMBL8676405 0.79 CYP3A4 (0.48) CYP3A4GABRA1GABRB2ALDH1A1
SCHEMBL10988378 0.79 CYP3A4 (0.42) CYP3A4GABRA1GABRB2GAAKMT2A
SCHEMBL10788007 0.79 CYP3A4 (0.36) CYP3A4GABRA1GABRB2GAAKDM4E
Formaldehyde SCHEMBL8766988 0.79 CYP3A4 (0.47) CYP3A4GABRA1GABRB2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113286836-B Composite materials based on dual-cured urethane and isocyanurate polymers 科思创知识产权两合公司 2024-02-13 CN disclosed
EP-4213628-A1 PYRETHROID IN-CAN ADJUVANTED SUSPENSION CONCENTRATES Bayer Aktiengesellschaft (DE) 2023-07-26 EP disclosed
CN-112204065-B Process for preparing polyisocyanate polymers and polyisocyanurate plastics 科思创知识产权两合公司 2023-03-28 CN disclosed
US-11319402-B2 Method for producing a polyisocyanate polymer and a polyisocyanurate plastic COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2022-05-03 US disclosed
EP-3914632-A1 COMPOSITE MATERIALS BASED ON DUAL-CURE URETHANE POLYMERS AND DUAL-CURE ISOCYANURATE POLYMERS Covestro Intellectual Property GmbH & Co. KG (DE) 2021-12-01 EP disclosed
CN-113286836-A Composite materials based on dual cure urethane and isocyanurate polymers 科思创知识产权两合公司 2021-08-20 CN disclosed
US-20210246255-A1 METHOD FOR PRODUCING A POLYISOCYANATE POLYMER AND A POLYISOCYANURATE PLASTIC COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2021-08-12 US disclosed
EP-3794049-A1 METHOD FOR PRODUCING A POLYISOCYANATE POLYMER AND A POLYISOCYANURATE PLASTIC Covestro Intellectual Property GmbH & Co. KG (DE) 2021-03-24 EP disclosed
CN-112204065-A Process for preparing polyisocyanate polymers and polyisocyanurate plastics 科思创知识产权两合公司 2021-01-08 CN disclosed
CN-108358831-A A kind of polysubstituted carbazole derivates and preparation method thereof 山东师范大学 2018-08-03 CN disclosed
EP-0671398-B1 Beta-lactam compound and method for the preparation thereof AGENCY IND SCIENCE TECHN (JP) 2000-04-26 EP disclosed
US-5700931-A 7-substituted-2-oxa 3.2.0!heptan-6-one compound and method for the preparation thereof JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1997-12-23 US disclosed
US-5550230-A INTERMEDIATES FOR SEDATIVES, HERBICIDES, ANTIBIOTICS JAPAN AS REPRESENTED BY DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1996-08-27 US disclosed
EP-0671398-A2 Beta-lactam compound and method for the preparation thereof JAPAN as represented by DIRECTOR GENERAL OF AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1995-09-13 EP disclosed
US-5426192-A Heat or pressure sensitive recording materials CIBA-GEIGY CORPORATION (US) 1995-06-20 US disclosed
US-5362872-A Used in pressure sensitive or heat sensitive recording CIBA-GEIGY CORPORATION (US) 1994-11-08 US disclosed
US-5329006-A Heat and pressure sensitive elements for copies CIBA-GEIGY CORPORATION (US) 1994-07-12 US disclosed