SCHEMBL19431330

SCHEMBL19431330

Cc1ccc2occc2c1C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 1/20 0.39
▸ MAPT P10636 3/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.35
▸ MAOA P21397 4/20 0.33
▸ MAOB P27338 4/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ CYP1A2 P05177 2/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ HTR2A P28223 2/20 0.32
▸ HTR2C P28335 2/20 0.32
▸ HTR2B P41595 1/20 0.32

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
SCHEMBL17841499 0.77 CYP2A6 (0.39) CYP2A6MAPTKDM4EALDH1A1HPGD
SCHEMBL29473759 0.77 CYP2A6 (0.39) CYP2A6MAPTKDM4EALDH1A1HPGD
SCHEMBL5684102 0.74 CYP1A2 (0.42) CYP2A6MAPTKDM4EALDH1A1HPGD
SCHEMBL8404363 0.73 MAOA (0.38) CYP2A6KDM4EALDH1A1HPGDHSD17B10
SCHEMBL7975208 0.71 CYP1A2 (0.46) CYP2A6MAPTKDM4EALDH1A1HPGD
SCHEMBL31050110 0.71 CYP1A2 (0.46) CYP2A6MAPTKDM4EALDH1A1HPGD
SCHEMBL17221561 0.69 MAOA (0.36) MAOAMAOBNFKB1HTR2AHTR2C
SCHEMBL14824860 0.69 HTR2A (0.38) KDM4EMAOAMAOBNFKB1HTR2A
SCHEMBL18876065 0.69 MAOA (0.36) MAOAMAOBNFKB1HTR2AHTR2C
SCHEMBL2048407 0.69 ALDH1A1 (0.42) CYP2A6MAPTKDM4EALDH1A1HPGD

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 6 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
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