SCHEMBL18879675

SCHEMBL18879675

Cc1cc(C#N)c2ncsc2c1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
DHODH Q02127 1/20 0.32
KDM4E B2RXH2 3/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL8012765 0.75 HSD17B10 (0.46) KDM4EMAPTHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL22242090 0.72 RIPK1 (0.37) HSD17B10
SCHEMBL15715213 0.72 HSD17B10 (0.32) HSD17B10
SCHEMBL2918075 0.72 HSD17B10 (0.32) HSD17B10
SCHEMBL18876143 0.71 KDM4E (0.33) KDM4EALOX15CASP1CASP7HSD17B10
SCHEMBL1438610 0.70 ALDH1A1 (0.41) XDHSLC22A12KDM4EMAPTHSD17B10
Hydrochloric Acid SCHEMBL23291099 0.69 ALDH1A1 (0.39) XDHSLC22A12KDM4EMAPTHSD17B10
SCHEMBL18876096 0.68 ALDH1A1 (0.34) KDM4EHSD17B10TDP1ALDH1A1HPGD
SCHEMBL12037021 0.66 MAPT (0.33) KDM4EMAPTHSD17B10ALDH1A1
SCHEMBL19431380 0.66 RECQL (0.36) KDM4EMAPTALOX15HSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11193065-B2 Liquid crystal composition, method of producing the same, and retardation film constituted from the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2021-12-07 US disclosed
US-20170306234-A1 LIQUID CRYSTAL COMPOSITION, METHOD OF PRODUCING THE SAME, AND RETARDATION FILM CONSTITUTED FROM THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-26 US disclosed
US-20170283700-A1 LIQUID CRYSTAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-10-05 US disclosed
US-20170145312-A1 LIQUID CRYSTAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-25 US disclosed