SCHEMBL7378752

SCHEMBL7378752

CC(CCCC(=O)O)CCC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.56
KDM5A P29375 3/20 0.43
PHF8 Q9UPP1 3/20 0.43
KDM2A Q9Y2K7 3/20 0.43
KDM4C Q9H3R0 2/20 0.43
KDM4A O75164 1/20 0.43
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.40
METAP1 P53582 1/20 0.40
ALDH1A1 P00352 1/20 0.39
EPHX2 P34913 1/20 0.37
CYP1A2 P05177 1/20 0.37
METAP2 P50579 1/20 0.36
CPB2 Q96IY4 1/20 0.36

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
SCHEMBL5695141 0.98 MAPT (0.58) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL7376739 0.95 MAPT (0.58) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL7377817 0.93 MAPT (0.65) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL7387306 0.92 MAPT (0.67) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL7385597 0.91 MAPT (0.66) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL4983489 0.90 MAPT (0.59) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL4983499 0.90 MAPT (0.59) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL7382699 0.88 MAPT (0.67) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL7380129 0.85 MAPT (0.46) MAPTKDM5APHF8KDM2AKDM4C
SCHEMBL7171947 0.84 MAPT (0.76) MAPTKDM5APHF8KDM2AKDM4C

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
EP-1192125-A2 MONO- AND DISUBSTITUTED 3-PROPYL GAMMA-AMINOBUTYRIC ACIDS WARNER-LAMBERT COMPANY (US) 2002-04-03 EP disclosed
WO-2000076958-A2 MONO- AND DISUBSTITUTED 3-PROPYL GAMMA-AMINOBUTYRIC ACIDS WARNER-LAMBERT COMPANY (US) 2000-12-21 WO disclosed