SCHEMBL1145161

SCHEMBL1145161

CSc1ccc(C#N)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.54
MAOA P21397 9/20 0.54
CYP2A6 P11509 2/20 0.52
ALDH1A1 P00352 1/20 0.52
CA12 O43570 1/20 0.46
CA2 P00918 1/20 0.46
CA3 P07451 1/20 0.46
CA6 P23280 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
ALOX5 P09917 1/20 0.45
TSHR P16473 1/20 0.43
LOXL2 Q9Y4K0 2/20 0.43
HDAC8 Q9BY41 1/20 0.42
KIF11 P52732 1/20 0.41
MMP3 P08254 1/20 0.41

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
SCHEMBL3761119 0.93 MAOB (0.65) MAOBMAOACYP2A6ALDH1A1CA12
SCHEMBL16844161 0.93 MMP3 (0.52) MAOBMAOACYP2A6ALDH1A1CA12
SCHEMBL8488924 0.89 MAOB (0.45) MAOBMAOACYP2A6ALDH1A1CA12
SCHEMBL2707459 0.87 PARP15 (0.49) MAOBMAOACYP2A6ALDH1A1CA2
SCHEMBL12230426 0.85 ALOX5 (0.48) MAOBMAOACYP2A6ALDH1A1CA12
SCHEMBL11757430 0.84 CA1 (0.50) MAOBMAOAALDH1A1CA2ALOX5
SCHEMBL8653346 0.81 PTGS2 (0.58) MAOBMAOACYP2A6ALDH1A1ALOX5
SCHEMBL18029896 0.78 ALOX5 (0.46) MAOBMAOACYP2A6ALDH1A1ALOX5
SCHEMBL223637 0.78 MAOB (0.58) MAOBMAOACYP2A6ALDH1A1CA12
SCHEMBL20681670 0.78 ACACB (0.52) MAOBMAOAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119985443-A Gold-silver alloy nano probe based on dual-signal cooperative detection, preparation method and application thereof 延边大学 2025-05-13 CN claimed
WO-2023027630-A9 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-07-27 WO claimed
CN-114409571-B Synthesis method of nitrile compound 重庆医科大学 2023-05-12 CN claimed
WO-2023027630-A2 A FLOW REACTOR, METHODS OF FABRICATION AND REACTIONS THEREOF NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-03-02 WO claimed
CN-114409571-A Method for synthesizing nitrile compound 重庆医科大学 2022-04-29 CN claimed
CN-109438512-A The preparation method of a kind of aromatic alkyl phosphorous oxide type compound 湖南大学 2019-03-08 CN claimed
EP-1304325-A1 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-04-23 EP claimed
EP-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 EP claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP claimed
EP-0743573-A2 Method for obtaining image contrast migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US claimed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US claimed
EP-0561898-A1 NOVEL PROCESS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1993-09-29 EP claimed
WO-1992010499-A1 NOVEL PROCESS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1992-06-25 WO claimed
WO-2025233865-A1 ENPP1 INHIBITORS RE VENTURES I, LLC (US) 2025-11-13 WO disclosed
EP-4613784-A1 ESTER COMPOUND-CONTAINING COMPOSITION, METHOD FOR PRODUCING SAME, POLYMERIZABLE COMPOSITION, (METH)ACRYLIC POLYMER, AND METHOD FOR PRODUCING SAME Mitsubishi Chemical Corporation (JP) 2025-09-10 EP disclosed
US-4081440-A Sulfinyl halides and their preparation from penicillin sulfoxides ELI LILLY AND COMPANY (US) 1978-03-28 US disclosed
US-4075203-A Process for preparing a 3-exomethylenecepham sulfoxide from penicillin sulfoxides ELI LILLY AND COMPANY (US) 1978-02-21 US disclosed
US-3962257-A 3-PHENACYLPIPERIDINES ELI LILLY AND COMPANY (US) 1976-06-08 US disclosed