SCHEMBL18301263

SCHEMBL18301263

CC=CC(=CC=CCCCC)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.42
PTPN1 P18031 4/20 0.41
F7 P08709 2/20 0.41
F3 P13726 2/20 0.41
KDM4E B2RXH2 1/20 0.40
TERT O14746 3/20 0.37
PPARG P37231 3/20 0.37
PPARD Q03181 3/20 0.37
PPARA Q07869 3/20 0.37
MAPT P10636 2/20 0.37
BLM P54132 2/20 0.37
HSD17B10 Q99714 2/20 0.37
FABP4 P15090 2/20 0.37
GMNN O75496 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL18301262 1.00 FASN (0.42) FASNPTPN1F7F3KDM4E
SCHEMBL10423108 0.93 FASN (0.51) FASNPTPN1F7F3KDM4E
SCHEMBL10423107 0.93 FASN (0.51) FASNPTPN1F7F3KDM4E
SCHEMBL432302 0.93 FASN (0.51) FASNPTPN1F7F3KDM4E
SCHEMBL432303 0.93 FASN (0.51) FASNPTPN1F7F3KDM4E
SCHEMBL30367114 0.93 FASN (0.51) FASNPTPN1F7F3KDM4E
SCHEMBL432723 0.80 PTPN1 (0.53) FASNPTPN1F7F3TERT
SCHEMBL432724 0.80 PTPN1 (0.53) FASNPTPN1F7F3TERT
SCHEMBL429510 0.79 FAAH (0.49) FASNPTPN1KDM4EMAPTBLM
SCHEMBL429511 0.79 FAAH (0.49) FASNPTPN1KDM4EMAPTBLM

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
WO-2016201052-A1 BRIDGED BICYCLIC KALLIKREIN INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-12-15 WO disclosed