SCHEMBL8538562

SCHEMBL8538562

CN(C(=O)c1cc(N(C)C(=O)c2cc([N+](=O)[O-])c[nH]2)c[nH]1)c1cc(C(=O)O)n(C)c1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 18/20 0.45
ATM Q13315 1/20 0.39
CSF1R P07333 1/20 0.34

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
SCHEMBL4701005 0.97 AR (0.47) ARATMCSF1R
SCHEMBL4703526 0.85 AR (0.39) ARATMCSF1R
SCHEMBL7645807 0.82 AR (0.33) ARATMCSF1R
SCHEMBL10693715 0.73 ATM (0.38) ATMCSF1R
SCHEMBL10694335 0.73 ATM (0.38) ATMCSF1R
SCHEMBL10690275 0.73 ATM (0.38) ATMCSF1R
SCHEMBL8640299 0.72 ATM (0.37) ATMCSF1R
SCHEMBL4701014 0.70 AR (0.51) ARATM
Hydrochloric Acid SCHEMBL10690256 0.70 ATM (0.36) ATM
Hydrochloric Acid SCHEMBL10693525 0.70 ATM (0.36) ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0880499-A1 DISTAMYCIN DERIVATIVES, PROCESS FOR PREPARING THEM, AND THEIR USE AS ANTITUMOR AND ANTIVIRAL AGENTS PHARMACIA & UPJOHN S.p.A. (IT) 1998-12-02 EP disclosed
WO-1997028123-A1 DISTAMYCIN DERIVATIVES, PROCESS FOR PREPARING THEM, AND THEIR USE AS ANTITUMOR AND ANTIVIRAL AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 1997-08-07 WO disclosed