SCHEMBL28833451

SCHEMBL28833451

CC(C)c1ccc(OB(O)O)cn1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ KDM4A O75164 1/20 0.37
▸ KDM5C P41229 1/20 0.37
▸ KDM4D Q6B0I6 1/20 0.37
▸ CACNA1I Q9P0X4 2/20 0.33
▸ CACNA1G O43497 1/20 0.33
▸ CACNA1H O95180 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ CHRNA7 P36544 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
SCHEMBL12190561 0.76 CACNA1I (0.43) KDM4CKDM4EKDM4AKDM5CKDM4D
SCHEMBL17766744 0.75 ALDH1A1 (0.46) —
SCHEMBL11951648 0.75 KDM4E (0.40) KDM4CKDM4EKDM4AKDM5CKDM4D
SCHEMBL5424020 0.75 KMT2A (0.42) —
SCHEMBL17721686 0.74 KDM4C (0.37) KDM4CKDM4EKDM4AKDM5CKDM4D
SCHEMBL13073830 0.74 SCN10A (0.41) KDM4CKDM4EKDM4AKDM5CKDM4D
SCHEMBL12303239 0.73 NQO1 (0.50) KDM4CKDM4EKDM4AKDM5CKDM4D
SCHEMBL23489320 0.73 NR1I2 (0.43) KDM4CKDM4EKDM4AKDM5CKDM4D
SCHEMBL2891613 0.72 CHRNB2 (0.37) —
SCHEMBL38660384 0.72 CHRNB2 (0.37) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115003655-B Cycloalkyl urea derivatives 住友制药株式会社 2025-03-21 — — CN disclosed
CN-115003655-A Cycloalkyl urea derivatives 住友制药株式会社 2022-09-02 — — CN disclosed
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