SCHEMBL18879652

SCHEMBL18879652

Cc1ccc(C#N)c2ccsc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
IMPDH2 P12268 1/20 0.34
IMPDH1 P20839 1/20 0.34
ALDH1A1 P00352 3/20 0.34
NEK1 Q96PY6 1/20 0.34
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
NPC1 O15118 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 1/20 0.30
AR P10275 1/20 0.30
DYRK1A Q13627 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
SCHEMBL19631236 0.84 NEK1 (0.37) IMPDH2IMPDH1ALDH1A1NEK1MAPT
SCHEMBL4804959 0.77 NEK1 (0.34) IMPDH2IMPDH1NEK1RAB9ADYRK1A
SCHEMBL6127813 0.77 CYP1A2 (0.39) TSHRALDH1A1MAPTKDM4EGAA
SCHEMBL4802256 0.77 IMPDH2 (0.54) TSHRIMPDH2IMPDH1ALDH1A1MAPT
SCHEMBL24946535 0.73 NEK1 (0.34) IMPDH2IMPDH1ALDH1A1NEK1MAPT
SCHEMBL29558893 0.73 NEK1 (0.34) IMPDH2IMPDH1ALDH1A1NEK1MAPT
SCHEMBL18879653 0.73 TSHR (0.34) TSHRALDH1A1MAPTKDM4EGAA
SCHEMBL10693338 0.72 TSHR (0.45) TSHRIMPDH2IMPDH1ALDH1A1MAPT
SCHEMBL18736630 0.69
SCHEMBL18876005 0.69 DYRK1A (0.40) ALDH1A1MAPTGAACYP2C19DYRK1A

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 7 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-20200165519-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION AND RETARDATION PLATE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-05-28 US disclosed
US-20190276744-A1 LIQUID CRYSTAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-09-12 US disclosed
US-10336938-B2 Liquid crystal composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2019-07-02 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