SCHEMBL34658

SCHEMBL34658

Nc1ccc(SSc2cccc(N)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
CASP1 P29466 1/20 0.48
RECQL P46063 1/20 0.48
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44
ANXA2 P07355 1/20 0.43
S100A10 P60903 1/20 0.43
CYP19A1 P11511 2/20 0.42
MAPT P10636 3/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MGLL Q99685 1/20 0.42
FBP1 P09467 1/20 0.40
PDE7A Q13946 1/20 0.39
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 2/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL34540 0.91 CYP3A4 (0.58) CYP3A4CASP1RECQLTSHRMAPK1
SCHEMBL29692549 0.82 CYP3A4 (0.64) CYP3A4CASP1RECQLTSHRMAPK1
4,4'-Thiodianiline SCHEMBL10715200 0.82 CYP3A4 (0.64) CYP3A4CASP1RECQLTSHRMAPK1
SCHEMBL125476 0.82 CYP3A4 (0.64) CYP3A4CASP1RECQLTSHRMAPK1
SCHEMBL9976795 0.81 CYP3A4 (0.52) CYP3A4CASP1RECQLTSHRMAPK1
SCHEMBL3246649 0.80 MAPT (0.67) CYP3A4TSHRMAPK1ANXA2S100A10
SCHEMBL34346 0.80 CYP3A4 (0.65) CYP3A4CASP1TSHRMAPK1MAPT
Aniline SCHEMBL27534786 0.78 MAPT (0.71) CYP3A4CASP1RECQLTSHRMAPK1
Hydrochloric Acid SCHEMBL3248171 0.77 CYP3A4 (0.61) CYP3A4CASP1TSHRMAPK1MAPT
SCHEMBL1098809 0.76 ANXA2 (0.55) CYP3A4CASP1RECQLTSHRMAPK1

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-115863528-A Negative electrode slurry for secondary battery and preparation method thereof 桂林电器科学研究院有限公司 2023-03-28 CN claimed
CN-116175720-A Waterproof flame-retardant wood composite floor and preparation method thereof 江苏名天木业有限公司 2023-05-30 CN disclosed
CN-115692709-A Negative electrode slurry for lithium ion battery and preparation method thereof 桂林电器科学研究院有限公司 2023-02-03 CN disclosed
EP-2290003-B1 Thermoplastic elastomer composition YOKOHAMA RUBBER CO LTD (JP) 2016-09-28 EP disclosed
EP-2281852-B1 PNEUMATIC TIRE COMPRISING A FILM COMPOSED OF A THERMOPLASTIC ELASTOMER COMPOSITION AS INNER LINER YOKOHAMA RUBBER CO LTD (JP) 2016-03-09 EP disclosed
US-8536271-B2 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. (JP) 2013-09-17 US disclosed
US-8378035-B2 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. (JP) 2013-02-19 US disclosed
EP-2290003-A2 Thermoplastic elastomer composition The Yokohama Rubber Company, Limited (JP) 2011-03-02 EP disclosed
EP-2281852-A1 Thermoplastic elastomer composition The Yokohama Rubber Company, Limited (JP) 2011-02-09 EP disclosed
US-20110028648-A1 THERMOPLASTIC ELASTOMER COMPOSITION THE YOKOHAMA RUBBER CO., LTD. (JP) 2011-02-03 US disclosed
US-20110028651-A1 THERMOPLASTIC ELASTOMER COMPOSITION THE YOKOHAMA RUBBER CO., LTD. (JP) 2011-02-03 US disclosed
US-6627377-B1 Soluble in organic solvents, which excels in adhesiveness, heat resistance, mechanical properties and flexibility, which shows properties of alkali-soluble highly sensitive positive-type photoresist PI R&D CO., LTD. (JP) 2003-09-30 US disclosed
EP-1024407-A1 POSITIVE PHOTOSENSITIVE POLYIMIDE COMPOSITION PI R & D Co Ltd (JP) 2000-08-02 EP disclosed
US-4931487-A Chain extenders for polyurethanes DOW CHEMICAL COMPANY 1990-06-05 US disclosed