SCHEMBL9450657

SCHEMBL9450657

ClOCl.Nc1ccc2[nH]cnc2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.61
MAPT P10636 5/20 0.59
KDM4E B2RXH2 4/20 0.59
RAD52 P43351 1/20 0.59
ALDH1A1 P00352 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
APEX1 P27695 1/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
PARP1 P09874 1/20 0.46
MAPKAPK2 P49137 1/20 0.46
RPS6KA3 P51812 1/20 0.46
CSNK2A1 P68400 1/20 0.46
PLK3 Q9H4B4 1/20 0.46
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MMP12 P39900 1/20 0.40
DYRK1A Q13627 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
SCHEMBL30832996 0.92 PRKCI (0.70) PRKCIMAPTKDM4ERAD52ALDH1A1
SCHEMBL115965 0.92 PRKCI (0.70) PRKCIMAPTKDM4ERAD52ALDH1A1
Hydrochloric Acid SCHEMBL5180321 0.90 MAPT (0.71) PRKCIMAPTKDM4ERAD52ALDH1A1
Hydrochloric Acid SCHEMBL9450655 0.90 MAPT (0.71) PRKCIMAPTKDM4ERAD52ALDH1A1
Pyrrole SCHEMBL9769511 0.82 PRKCI (0.58) PRKCIMAPTKDM4ERAD52ALDH1A1
SCHEMBL7013286 0.77 PRKCI (0.51) PRKCIMAPTKDM4ERAD52ALDH1A1
SCHEMBL115966 0.76 PRKCI (1.00) PRKCIMAPTKDM4ERAD52ALDH1A1
SCHEMBL7352415 0.75 PRKCI (0.45) PRKCIMAPTKDM4ERAD52ALDH1A1
SCHEMBL21409922 0.75 MEN1 (0.53) PRKCIMAPTKDM4ERAD52ALDH1A1
SCHEMBL7783498 0.75 PRKCI (0.49) PRKCIMAPTKDM4ERAD52ALDH1A1

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
US-5187054-A In top protective layer and covering silver halide emulsion to prevent diffusion of silver ions into developing solution AGFA-GEVAERT N.V. (BE) 1993-02-16 US disclosed
EP-0520092-A1 Anti-sludging compounds in photographic material AGFA-GEVAERT naamloze vennootschap (BE) 1992-12-30 EP disclosed