SCHEMBL23969319

SCHEMBL23969319

C=C(N)CCCc1ccc(C)cc1C(=C)CC

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL23969391 0.84 TAAR1 (0.37) TAAR1MEN1KMT2A
SCHEMBL23969340 0.84 TAAR1 (0.37) TAAR1MEN1KMT2A
SCHEMBL22175858 0.79 L3MBTL4 (0.38)
SCHEMBL22175863 0.78 SIGMAR1 (0.37) MEN1KMT2A
SCHEMBL22176523 0.78 SIGMAR1 (0.37) MEN1KMT2A
SCHEMBL22175908 0.78 SIGMAR1 (0.37) MEN1KMT2A
SCHEMBL23969232 0.77 HRH4 (0.34) MEN1KMT2A
SCHEMBL22175868 0.74 GABRG2 (0.31)
SCHEMBL23969349 0.73 CNR1 (0.38) KMT2A
SCHEMBL22176371 0.73 SIGMAR1 (0.36)

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-3903788-A1 PYRAZOLO[1,5-A]PYRIMIDINE MACROCYCLIC COMPOUND Taisho Pharmaceutical Co., Ltd. (JP) 2021-11-03 EP disclosed