SCHEMBL27472905

SCHEMBL27472905

CCCOCn1cnc2c(COC)cc(C(=O)OC)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ YTHDC1 Q96MU7 3/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ NLRP3 Q96P20 1/20 0.32
▸ POLB P06746 2/20 0.32
▸ TSHR P16473 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KDM5A P29375 1/20 0.31
▸ KDM4C Q9H3R0 1/20 0.31
▸ KDM5B Q9UGL1 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRG2 P18507 1/20 0.31

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
SCHEMBL30962604 0.89 NPC1 (0.35) YTHDC1KDM4EALDH1A1CA12CA1
SCHEMBL27472903 0.80 PDE5A (0.31) —
SCHEMBL30962565 0.79 NPC1 (0.35) POLB
SCHEMBL27472916 0.77 MCHR1 (0.39) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL309368 0.70 KDM4E (0.41) YTHDC1KDM4EALDH1A1CA12CA1
SCHEMBL30962581 0.69 MCHR1 (0.37) KDM4EALDH1A1MAPT
SCHEMBL27472897 0.69 USP2 (0.33) KDM4ETSHRBRD4
SCHEMBL30962569 0.69 DGAT1 (0.34) —
SCHEMBL5219842 0.69 KDM4E (0.40) YTHDC1KDM4EALDH1A1CA12CA1
SCHEMBL29159923 0.68 KMT2A (0.43) YTHDC1KDM4EALDH1A1POLBMAPT

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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