SCHEMBL8901573

SCHEMBL8901573

CCCCN(CCCC)C(N)=S.CCN(CC)C(N)=S

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 8/20 0.57
CA1 P00915 8/20 0.57
CA9 Q16790 8/20 0.57
CA2 P00918 6/20 0.57
ALDH1A1 P00352 3/20 0.50
ALDH2 P05091 3/20 0.50
MGLL Q99685 2/20 0.48
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
EHMT2 Q96KQ7 3/20 0.37
EHMT1 Q9H9B1 3/20 0.37
ABCB11 O95342 2/20 0.37
HTT P42858 2/20 0.37
GSDMD P57764 2/20 0.37
CA4 P22748 2/20 0.37
CYP2E1 P05181 1/20 0.37
PTGS1 P23219 1/20 0.37
HPGD P15428 2/20 0.36

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
SCHEMBL9666762 0.93 CA12 (0.59) CA12CA1CA9CA2ALDH1A1
SCHEMBL15420 0.93 ALDH1A1 (0.56) CA12CA1CA9CA2ALDH1A1
SCHEMBL28483475 0.91 ALDH1A1 (0.54) CA12CA1CA9CA2ALDH1A1
SCHEMBL28495992 0.88 ALDH1A1 (0.52) CA12CA1CA9CA2ALDH1A1
SCHEMBL1101234 0.86 CA12 (0.58) CA12CA1CA9CA2ALDH1A1
SCHEMBL9665522 0.84 MGLL (0.62) CA12CA1CA9CA2ALDH1A1
SCHEMBL28929084 0.84 ALDH1A1 (0.48) CA12CA1CA9CA2ALDH1A1
SCHEMBL11048733 0.84 MGLL (0.62) CA12CA1CA9CA2ALDH1A1
SCHEMBL635408 0.84 CA12 (0.61) CA12CA1CA9CA2ALDH1A1
SCHEMBL9665534 0.84 CA12 (0.61) CA12CA1CA9CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023149461-A1 CYCLIC OLEFIN-BASED COPOLYMER, CYCLIC OLEFIN-BASED COPOLYMER COMPOSITION, VARNISH, CROSSLINKED BODY, FILM OR SHEET, LAYERED PRODUCT, CIRCUIT BOARD, ELECTRONIC DEVICE AND PREPREG 三井化学株式会社 2023-08-10 WO disclosed
EP-3085735-B1 RUBBER COMPOSITION AND MOLDED ARTICLE SUMITOMO CHEMICAL CO (JP) 2019-02-20 EP disclosed
US-9809704-B2 Rubber composition and molded article SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-11-07 US disclosed
US-20160304710-A1 RUBBER COMPOSITION AND MOLDED ARTICLE ETIC INC. (JP) 2016-10-20 US disclosed
US-9206278-B2 Cyclic olefin copolymer and crosslinked polymer thereof MITSUI CHEMICALS, INC. (JP) 2015-12-08 US disclosed
US-20130178575-A1 CYCLIC OLEFIN COPOLYMER AND CROSSLINKED POLYMER THEREOF MITSUI CHEMICALS, INC. (JP) 2013-07-11 US disclosed
EP-0778852-A1 THERMOSET ELASTOMERS THE DOW CHEMICAL COMPANY (US) 1997-06-18 EP disclosed
WO-1996007681-A1 THERMOSET ELASTOMERS THE DOW CHEMICAL COMPANY (US) 1996-03-14 WO disclosed