SCHEMBL8777957

SCHEMBL8777957

NC(=O)NCc1ccc2c(c1)CCN2c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.48
TP53 P04637 5/20 0.48
OPRM1 P35372 3/20 0.47
OPRK1 P41145 3/20 0.47
OPRD1 P41143 2/20 0.47
POLB P06746 2/20 0.46
ACHE P22303 1/20 0.45
THRB P10828 1/20 0.44
MAPT P10636 2/20 0.44

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
SCHEMBL4784159 0.79 ACHE (0.44) TP53OPRM1OPRK1OPRD1ACHE
SCHEMBL8777936 0.78 TP53 (0.52) LMNATP53POLBTHRBMAPT
SCHEMBL8778126 0.75 LMNA (0.48) LMNATP53POLBMAPT
SCHEMBL33720871 0.75 LMNA (0.67) LMNATP53POLBTHRBMAPT
SCHEMBL8778095 0.74 FFAR1 (0.47) LMNATP53POLBMAPT
SCHEMBL10640396 0.72 TP53 (0.53) LMNATP53MAPT
SCHEMBL9206866 0.72 OPRM1 (0.49) LMNATP53OPRM1OPRK1OPRD1
SCHEMBL8778007 0.72 LMNA (0.50) LMNATP53THRB
SCHEMBL12283585 0.72 ALDH1A1 (0.49) LMNATP53ACHEMAPT
SCHEMBL29973320 0.72 ALDH1A1 (0.49) LMNATP53ACHEMAPT

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
EP-0651743-B1 INDOLINYL N-HYDROXYUREA AND N-HYDROXAMIC ACID DERIVATIVES AS LIPOXYGENASE INHIBITORS PFIZER (US) 1997-12-17 EP disclosed