SCHEMBL7303824

SCHEMBL7303824

O=C(O)c1ccnc(NC(=O)C(Cc2ccccc2)NP(=O)(OCc2ccccc2)OCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 1/20 0.43
IL1RN P18510 1/20 0.42
GCK P35557 2/20 0.41
KDM5A P29375 4/20 0.40
KDM5B Q9UGL1 4/20 0.40
KDM4C Q9H3R0 3/20 0.40
GPR132 Q9UNW8 4/20 0.40
NR1H4 Q96RI1 1/20 0.40
MAPT P10636 1/20 0.39
GSK3B P49841 1/20 0.39
MEP1B Q16820 2/20 0.39
KDM4E B2RXH2 1/20 0.39
KDM5C P41229 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TACR1 P25103 1/20 0.38

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
SCHEMBL7306530 0.91 LNPEP (0.45) LNPEPIL1RNKDM5BMAPTGSK3B
SCHEMBL7297368 0.86 KDM5A (0.44) KDM5AKDM5BKDM4CMAPTGSK3B
SCHEMBL7269082 0.75 GPR132 (0.49) GPR132TACR1
SCHEMBL7269089 0.75 GPR132 (0.49) GPR132TACR1
SCHEMBL10778660 0.74 MME (0.51) MAPTALDH1A1
SCHEMBL7307409 0.73 LAP3 (0.42) KDM5AKDM5BKDM4C
SCHEMBL7295772 0.73 TACR1 (0.54) ALDH1A1TACR1
Lithium Ion SCHEMBL7297039 0.73 KDM4A (0.41) IL1RNKDM5BKDM4CMAPTGSK3B
SCHEMBL9244629 0.72 LNPEP (0.42) LNPEPIL1RNKDM5BKDM4CMAPT
SCHEMBL7301392 0.72 KDM5B (0.42) LNPEPIL1RNKDM5BGPR132MAPT

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
EP-0636630-B1 N-heteroaryl substituted derivatives of propanamide useful in the treatment of cardiovascular diseases ZAMBON SPA (IT) 1999-04-28 EP disclosed
US-5438046-A Enzyme inhibitors ZAMBON GROUP S.P.A. (IT) 1995-08-01 US disclosed
EP-0636630-A1 N-heteroaryl substituted derivatives of propanamide useful in the treatment of cardiovascular diseases ZAMBON GROUP S.p.A. (IT) 1995-02-01 EP disclosed