SCHEMBL25530094

SCHEMBL25530094

CC(C)(C)c1cc(Cl)nc(F)n1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 1/20 0.35
▸ GABRA2 P47869 1/20 0.33
▸ GABRB2 P47870 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ SQOR Q9Y6N5 1/20 0.30
▸ KDM4E B2RXH2 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
SCHEMBL11116149 0.80 CYP3A4 (0.40) —
SCHEMBL24848200 0.78 HRH4 (0.35) HRH4GABRA2GABRB2HSD17B10SQOR
SCHEMBL29438115 0.77 HRH4 (0.49) HRH4HSD17B10KDM4E
SCHEMBL2721824 0.77 HRH4 (0.49) HRH4HSD17B10KDM4E
SCHEMBL2625506 0.76 ALDH1A1 (0.38) HRH4HSD17B10KDM4E
SCHEMBL7255653 0.76 HMGCR (0.37) HRH4HSD17B10KDM4E
SCHEMBL9018832 0.75 — —
SCHEMBL5748941 0.74 HSD17B10 (0.55) HRH4HSD17B10KDM4E
SCHEMBL29566785 0.74 HSD17B10 (0.55) HRH4HSD17B10KDM4E
SCHEMBL10220676 0.73 HRH4 (0.37) HRH4HSD17B10KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159780-A1 INKJET INK, USES THEREOF AND RELATED COMPOSITIONS, FABRICS, METHOD AND SYSTEMS GUANGZHOU JINGYILVFANG TECHNOLOGY CO., LTD (CN) 2023-05-25 — — US disclosed
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