SCHEMBL27472916

SCHEMBL27472916

CCCOCn1cnc2c(COC)cc(C(=O)N(C)c3ccc(F)c(OC)c3)cc21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 9/20 0.39
▸ ALKBH1 Q13686 1/20 0.33
▸ GRIN2B Q13224 4/20 0.32
▸ ORAI1 Q96D31 1/20 0.32
▸ CYP2C8 P10632 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ CYP2B6 P20813 1/20 0.32
▸ TACR2 P21452 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA5 P31644 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ GABRA3 P34903 1/20 0.32
▸ GABRB2 P47870 1/20 0.32
▸ KCNH2 Q12809 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
SCHEMBL30962497 0.92 MCHR1 (0.36) MCHR1ALKBH1ORAI1
SCHEMBL30962581 0.85 MCHR1 (0.37) MCHR1ALKBH1
SCHEMBL27472921 0.77 MCHR1 (0.35) MCHR1ORAI1
SCHEMBL30962511 0.77 MCHR1 (0.35) MCHR1ORAI1
SCHEMBL27472905 0.77 YTHDC1 (0.34) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL30962499 0.76 HPGD (0.32) MCHR1CYP2C9CYP2C19KCNH2
SCHEMBL27472894 0.76 HPGD (0.32) MCHR1CYP2C9CYP2C19KCNH2
SCHEMBL30962542 0.72 MCHR1 (0.33) MCHR1ALKBH1GRIN2B
SCHEMBL31108804 0.71 ALKBH1 (0.37) MCHR1ALKBH1ORAI1
SCHEMBL30962596 0.71 MCHR1 (0.38) MCHR1ORAI1

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
WO-2024126407-A1 BENZIMIDAZOLE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-06-20 — — WO disclosed
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