SCHEMBL23949240

SCHEMBL23949240

Cn1nc(N)cc1Oc1cc(C#N)ccc1-c1ncc(CN)cn1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 8/20 0.38
EGLN2 Q96KS0 1/20 0.35
GRM5 P41594 5/20 0.34
CYP19A1 P11511 2/20 0.34
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34
PRKDC P78527 1/20 0.33
ALOX5AP P20292 2/20 0.32
FEN1 P39748 2/20 0.32
SCN9A Q15858 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
SCHEMBL25058663 0.89 NSD2 (0.37) NSD2EGLN2GRM5CYP19A1CYP11B1
SCHEMBL30257183 0.89 NSD2 (0.37) NSD2EGLN2GRM5CYP19A1CYP11B1
SCHEMBL30353072 0.88 NSD2 (0.37) NSD2GRM5CYP19A1CYP11B1CYP11B2
SCHEMBL25554342 0.88 NSD2 (0.37) NSD2GRM5CYP19A1CYP11B1CYP11B2
SCHEMBL30257092 0.88 NSD2 (0.37) NSD2GRM5CYP19A1CYP11B1CYP11B2
SCHEMBL25554407 0.88 NSD2 (0.37) NSD2GRM5CYP19A1CYP11B1CYP11B2
SCHEMBL30257104 0.87 NSD2 (0.36) NSD2GRM5CYP19A1CYP11B1CYP11B2
SCHEMBL23949601 0.87 NSD2 (0.39) NSD2CYP19A1CYP11B1CYP11B2PRKDC
SCHEMBL30353055 0.87 NSD2 (0.39) NSD2CYP19A1CYP11B1CYP11B2PRKDC
SCHEMBL25555246 0.87 NSD2 (0.36) NSD2GRM5CYP19A1CYP11B1CYP11B2

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-4137481-A1 ARYL OR HETEROARYL DERIVATIVE Teijin Pharma Limited (JP) 2023-02-22 EP disclosed
WO-2021210650-A1 ARYL OR HETEROARYL DERIVATIVE 帝人ファーマ株式会社 2021-10-21 WO disclosed