SCHEMBL22146147

SCHEMBL22146147

O=CCn1ccc2scc(-c3ccc(Cl)c(Cl)c3)c2c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHB4 P54760 1/20 0.36
LMNA P02545 1/20 0.36
PRKCZ Q05513 3/20 0.34
PKM P14618 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
AHR P35869 2/20 0.33
NPSR1 Q6W5P4 2/20 0.32
GRM2 Q14416 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31

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
SCHEMBL18965126 0.90 EPHB4 (0.49) EPHB4LMNAPKM
SCHEMBL22146385 0.90 LMNA (0.43) EPHB4LMNAPKMNPSR1POLB
SCHEMBL22146193 0.90 EPHB4 (0.39) EPHB4LMNAPKMNPSR1GRM2
SCHEMBL22146189 0.87 NOTUM (0.36) EPHB4LMNAPKMCYP1A2
SCHEMBL22146201 0.85 PKM (0.45) EPHB4LMNAPRKCZPKMPIK3CD
SCHEMBL22146209 0.84 NPSR1 (0.34) EPHB4LMNAPKMNPSR1GRM2
SCHEMBL22146195 0.82 EPHB4 (0.37) EPHB4LMNAPKMNPSR1GRM2
SCHEMBL22146197 0.81 LMNA (0.43) EPHB4LMNAPKMNPSR1POLB
SCHEMBL22146154 0.79 TRPA1 (0.36) EPHB4LMNAPKM
SCHEMBL22146148 0.78 LMNA (0.41) LMNAPKMNPSR1CYP1A2CYP3A4

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-3386591-B1 HETEROAROMATIC NMDA RECEPTOR MODULATORS AND USES THEREOF CADENT THERAPEUTICS INC (US) 2020-06-24 EP disclosed