SCHEMBL10866646

SCHEMBL10866646

COc1ccc([C@@H](N)[C@@H](N)c2ccc(OC)c(OC)c2)cc1OC.Cl[Pt]Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.54
CA2 P00918 3/20 0.46
CA1 P00915 2/20 0.46
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.44
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 2/20 0.42
CA12 O43570 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 2/20 0.40
CRHBP P24387 1/20 0.40

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
SCHEMBL9745531 0.92 ACHE (0.61) ACHECA2CA1PPARGPPARD
SCHEMBL10865644 0.92 ACHE (0.51) ACHECA2CA1PPARGPPARD
SCHEMBL10781197 0.83 ACHE (0.57) ACHECA2CA1PPARGPPARD
SCHEMBL8203270 0.82 ACHE (0.56) ACHECA2CA1PPARGPPARD
Hydrochloric Acid SCHEMBL5138937 0.81 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL5283320 0.79 ACHE (0.74) ACHECA2CA1PPARGPPARD
SCHEMBL1719900 0.78 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL3976767 0.78 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL3635226 0.78 ACHE (0.54) ACHECA2CA1PPARGPPARD
SCHEMBL29975311 0.78 ACHE (0.54) ACHECA2CA1PPARGPPARD

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
US-4598091-A (1,2-diphenyl)-ethylenediamine)-platinum (II) complex compounds DEGUSSA AKTIENGESELLSCHAFT (DE) 1986-07-01 US disclosed