SCHEMBL11610558

SCHEMBL11610558

Cc1cc(OC(=O)c2cccc(Cl)c2)n(CCOc2ccc3ccccc3c2)n1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ ALOX15 P16050 2/20 0.50
▸ LMNA P02545 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A4 P31645 1/20 0.45
▸ RAB9A P51151 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ SRC P12931 1/20 0.41
▸ MAOB P27338 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ PKM P14618 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
SCHEMBL11613653 0.90 MAPT (0.52) MAPTKMT2AALOX15TP53SLC6A2
SCHEMBL11615774 0.86 KMT2A (0.53) MAPTKMT2AALOX15LMNATP53
SCHEMBL11618012 0.86 KMT2A (0.42) MAPTKMT2AALOX15LMNASLC6A2
SCHEMBL11613986 0.85 KMT2A (0.53) MAPTKMT2AALOX15LMNATP53
SCHEMBL11615128 0.84 KMT2A (0.47) MAPTKMT2AALOX15SLC6A2SLC6A4
SCHEMBL11615175 0.84 MAPT (0.52) MAPTKMT2AALOX15LMNATP53
SCHEMBL11612294 0.82 RAB9A (0.48) MAPTKMT2AALOX15LMNARAB9A
SCHEMBL11615378 0.80 KMT2A (0.49) MAPTKMT2AALOX15SLC6A2SLC6A4
SCHEMBL11619227 0.79 MAPT (0.53) MAPTKMT2AALOX15LMNATP53
SCHEMBL11601121 0.75 LMNA (0.56) MAPTKMT2AALOX15LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4117145-A DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1978-09-26 — — US disclosed
US-4117143-A USED AS ANTITHROMBOTIC AGENTS BAYER AKTIENGESELLSCHAFT (DE) 1978-09-26 — — US disclosed
US-4113957-A DIURETIC, SALURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DE) 1978-09-12 — — US disclosed
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