SCHEMBL24612188

SCHEMBL24612188

CC1(c2nc(C(=N)ON)c(N3CCOCC3)s2)CC1

nearest known ligand 0.30

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 2/20 0.30
▸ PIK3CA P42336 2/20 0.30
▸ PIK3CB P42338 2/20 0.30
▸ SMN1; SMN2 Q16637 2/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ MAPK1 P28482 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
SCHEMBL20866963 0.96 PIK3CD (0.30) PIK3CDPIK3CAPIK3CBSMN1; SMN2PIK3CG
SCHEMBL20867257 0.84 SYK (0.31) —
SCHEMBL20866762 0.84 PIK3CA (0.30) PIK3CA
SCHEMBL20866691 0.81 MAPK1 (0.31) SMN1; SMN2KDM4EALDH1A1GAAMAPT
SCHEMBL20867295 0.81 — —
SCHEMBL24612210 0.76 FBP1 (0.31) KDM4E
SCHEMBL20866838 0.76 ATM (0.32) PIK3CDPIK3CAPIK3CBSMN1; SMN2KDM4E
SCHEMBL24612293 0.75 ATM (0.31) SMN1; SMN2KDM4EALDH1A1GAAMAPT
SCHEMBL20867306 0.74 ATM (0.31) —
SCHEMBL20866960 0.73 ATM (0.32) PIK3CDPIK3CAPIK3CBSMN1; SMN2KDM4E

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
EP-3324977-B1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARM INC (US) 2022-07-13 — — EP disclosed
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