SCHEMBL7285448

SCHEMBL7285448

CCCCCC(=O)Oc1ccccc1C=O

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
KDM4E B2RXH2 1/20 0.57
MEN1 O00255 1/20 0.57
RECQL P46063 1/20 0.57
POLM Q9NP87 2/20 0.52
POLK Q9UBT6 2/20 0.52
POLL Q9UGP5 2/20 0.52
POLH Q9Y253 2/20 0.52
ALOX15 P16050 1/20 0.49
PTGDR2 Q9Y5Y4 1/20 0.47
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PPARG P37231 1/20 0.46
TOP2A P11388 2/20 0.45
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
SRC P12931 1/20 0.42

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
SCHEMBL20143639 0.95 KMT2A (0.63) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL1201154 0.89 ALDH1A1 (0.52) KMT2AKDM4EMEN1RECQLALOX15
SCHEMBL1908275 0.88 KDM4E (0.55) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL10407328 0.87 KDM4E (0.68) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL27579253 0.87 KDM4E (0.54) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL4644325 0.86 PTGDR2 (0.49) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL2763300 0.86 PTGDR2 (0.49) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL15548290 0.85 KMT2A (0.66) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL15548035 0.85 KMT2A (0.66) KMT2AKDM4EMEN1RECQLPOLM
SCHEMBL15548862 0.85 KMT2A (0.66) KMT2AKDM4EMEN1RECQLPOLM

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-4760064-A Cardiotonic agent OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-07-26 US disclosed
EP-0187322-A1 Carbostyril compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-07-16 EP disclosed