SCHEMBL25060934

SCHEMBL25060934

O=C1c2ccc(-c3ccc4c(c3)CN(O)C4=O)cc2CN1O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.38
▸ PIK3CG P48736 1/20 0.36
▸ UGCG Q16739 1/20 0.36
▸ HRH3 Q9Y5N1 3/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ KMT2A Q03164 1/20 0.35

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
SCHEMBL30833835 0.81 METAP1 (0.47) KMT2A
SCHEMBL23511687 0.81 HRH3 (0.47) HSD17B1HRH3HTR1AKCNH2
SCHEMBL24692214 0.77 ITGB3 (0.38) KDM4EKMT2A
SCHEMBL18464134 0.77 HTR2A (0.46) KDM4EKMT2A
SCHEMBL4725874 0.75 KMT2A (0.63) KDM4EKMT2A
SCHEMBL25060904 0.73 RNASEH1 (0.62) HSD17B1
SCHEMBL21013541 0.69 PRF1 (0.44) UGCG
SCHEMBL28625588 0.68 NPC1 (0.65) PIK3CGHRH3HTR1AKMT2A
SCHEMBL25087855 0.66 MAOA (0.36) HRH3
SCHEMBL21013539 0.66 CTSC (0.46) KDM4EUGCG

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-20230056785-A1 GAS-STORING MATERIAL INCLUDING METAL/ORGANIC FRAMEWORK BONDED BY HYDROXAMIC ACID RIKKYO EDUCATIONAL CORPORATION (JP) 2023-02-23 — — US disclosed
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