SCHEMBL10700665

SCHEMBL10700665

NCNC1CCCCCCC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ANPEP P15144 2/20 0.42
ERAP2 Q6P179 2/20 0.42
EPHX1 P07099 1/20 0.42
DPP7 Q9UHL4 2/20 0.41
HRH3 Q9Y5N1 1/20 0.41
PABPC1 P11940 1/20 0.40
TP53 P04637 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
RAD52 P43351 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL1578201 1.00
SCHEMBL25109785 1.00 KDM4E (0.48) KDM4EALDH1A1HSD17B10ANPEPERAP2
SCHEMBL389799 0.97
SCHEMBL13703453 0.91
Hydrochloric Acid SCHEMBL14994858 0.88
SCHEMBL722433 0.84
Hydrochloric Acid SCHEMBL27719124 0.81
SCHEMBL1913633 0.80 KDM4E (0.46) KDM4EALDH1A1HSD17B10ANPEPERAP2
SCHEMBL23016010 0.80 KDM4E (0.46) KDM4EALDH1A1HSD17B10ANPEPERAP2
SCHEMBL24029510 0.80 KDM4E (0.46) KDM4EALDH1A1HSD17B10ANPEPERAP2

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-0290169-A2 Diamineplatinum complexes with phosphonocarboxylate and substituted phosphonocarboxylate ligands as antitumor agents ENGELHARD CORPORATION (US) 1988-11-09 EP disclosed