SCHEMBL9518705

SCHEMBL9518705

COCCOCCOCCOCCOCCOCCOCCOCCOCCC(CCOCCOCCOCCOCCOCCOCCOCCOCCOC)(C(=O)O)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.35
ARG2 P78540 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CA2 P00918 1/20 0.33
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL9518761 1.00 ARG1 (0.35) ARG1ARG2ALDH1A1CA2TSHR
SCHEMBL9516132 1.00 ARG1 (0.35) ARG1ARG2ALDH1A1CA2TSHR
SCHEMBL9514902 1.00 ARG1 (0.35) ARG1ARG2ALDH1A1CA2TSHR
SCHEMBL9514891 1.00 ARG1 (0.35) ARG1ARG2ALDH1A1CA2TSHR
SCHEMBL9516615 0.98 ARG1 (0.34) ARG1ARG2ALDH1A1CA2
Ethylenediamine SCHEMBL9514962 0.94 ARG1 (0.36) ARG1ARG2ALDH1A1CA2
SCHEMBL9516482 0.85 MME (0.32) ARG1ARG2
SCHEMBL9518194 0.85
SCHEMBL9516411 0.85 MME (0.32) ARG1ARG2
SCHEMBL838660 0.79 KDM4E (0.33) ARG1ARG2ALDH1A1CA2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0341409-B1 Platinum (II) complexes, their preparation and use as antitumour agents BOEHRINGER MANNHEIM ITALIA (IT) 1993-12-29 EP disclosed
EP-0415939-A1 PLATINUM(II) COMPLEXES, THEIR PREPARATION AND USE AS ANTI-TUMOUR AGENTS BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1991-03-13 EP disclosed
EP-0341409-A1 Platinum (II) complexes, their preparation and use as antitumour agents BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) 1989-11-15 EP disclosed
WO-1989009218-A1 PLATINUM(II) COMPLEXES, THEIR PREPARATION AND USE AS ANTI-TUMOUR AGENTS BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) 1989-10-05 WO disclosed