SCHEMBL28664192

SCHEMBL28664192

Nc1nccc(C(O)=S)c1C1CC1.[KH]

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ USP7 Q93009 1/20 0.34
▸ KDM5A P29375 1/20 0.33
▸ KDM5B Q9UGL1 1/20 0.33
▸ NAPRT Q6XQN6 1/20 0.33
▸ MAPKAPK2 P49137 1/20 0.30
▸ PRKCI P41743 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
SCHEMBL28664194 0.79 KDM5A (0.35) USP7KDM5AKDM5BNAPRTPRKCI
SCHEMBL28645004 0.70 KDM5A (0.33) KDM5AKDM5B
SCHEMBL28907422 0.69 NOS3 (0.37) USP7PRKCI
SCHEMBL26471836 0.69 USP7 (0.35) USP7PRKCI
SCHEMBL26686534 0.69 USP7 (0.35) USP7PRKCI
SCHEMBL23901911 0.69 USP7 (0.35) USP7PRKCI
SCHEMBL22493647 0.69 USP7 (0.35) USP7PRKCI
Potassium Ion SCHEMBL28907435 0.68 USP7 (0.34) USP7PRKCI
SCHEMBL28915965 0.67 USP7 (0.38) USP7
SCHEMBL3388421 0.66 NOS3 (0.37) USP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115052866-A Crystal form of free base of nitrogen-containing heteroaromatic derivative 上海翰森生物医药科技有限公司 2022-09-13 — — CN disclosed
CN-113493440-A Salt of nitrogen-containing heteroaromatic derivative and crystal form thereof 上海翰森生物医药科技有限公司 2021-10-12 — — CN disclosed
CN-111295374-A Aza-containing aromatic derivative regulator, preparation method and application thereof 江苏豪森药业集团有限公司 2020-06-16 — — CN disclosed
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