SCHEMBL30801060

SCHEMBL30801060

COC(=O)N(C)[C@@H](CCCN(C)C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4A O75164 10/20 0.33
▸ KDM4C Q9H3R0 10/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ FOLH1 Q04609 1/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ KDM7A Q6ZMT4 1/20 0.33
▸ PHF8 Q9UPP1 1/20 0.33
▸ KDM2A Q9Y2K7 1/20 0.33
▸ UTS2R Q9UKP6 1/20 0.33
▸ NOS3 P29474 1/20 0.33
▸ NOS1 P29475 1/20 0.33
▸ NOS2 P35228 1/20 0.33

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
SCHEMBL29166024 0.95 KDM4A (0.36) KDM4AKDM4CFOLH1KDM5AKDM7A
SCHEMBL29166041 0.81 CHRM2 (0.35) KDM4AKDM4CKDM5AKDM7APHF8
SCHEMBL30476795 0.80 CHRM1 (0.45) HTR2AHRH1
SCHEMBL30957333 0.78 FOLH1 (0.48) FOLH1
SCHEMBL30476800 0.76 FOLH1 (0.45) HTR2AHRH1FOLH1
SCHEMBL20165468 0.76 USP2 (0.31) —
SCHEMBL14879165 0.74 ALDH1A1 (0.32) —
SCHEMBL11226698 0.72 ALDH1A1 (0.40) KDM4AKDM4CHTR2AHRH1KDM5A
SCHEMBL15710764 0.71 HTR2A (0.43) KDM4AKDM4CHTR2AHRH1KDM5A
SCHEMBL15711311 0.69 HTR2A (0.42) KDM4AKDM4CHTR2AHRH1KDM5A

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
CN-117460743-A Small molecule VE-PTP inhibitors 曼宁研究公司 2024-01-26 — — CN disclosed
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