SCHEMBL26031344

SCHEMBL26031344

Cc1cnn(C2CN(C)C2)c(=O)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.41
ALOX15 P16050 1/20 0.35
GRM2 Q14416 1/20 0.32
PDE1A P54750 1/20 0.32
PDE1B Q01064 1/20 0.32
PDE1C Q14123 1/20 0.32
KAT2B Q92831 3/20 0.31
SSTR4 P31391 1/20 0.30
BRD4 O60885 1/20 0.30
BRD2 P25440 1/20 0.30
BRD3 Q15059 1/20 0.30
CREBBP Q92793 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
SCHEMBL25975010 0.81 CNR2 (0.40) CNR2ALOX15KAT2B
SCHEMBL20116866 0.69 KMO (0.43) PDE1APDE1BPDE1C
SCHEMBL8404399 0.69
SCHEMBL26692292 0.68 ALOX15 (0.44) ALOX15
SCHEMBL15889590 0.68 ALDH1A1 (0.48) PDE1APDE1BPDE1C
SCHEMBL20412794 0.67 OGA (0.38) ALOX15
SCHEMBL26031341 0.67 OPRM1 (0.35)
SCHEMBL20128675 0.66 CRBN (0.54)
SCHEMBL21946927 0.64 CNR2 (0.32) CNR2
SCHEMBL25105761 0.63

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-2023154282-A1 COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS THERAS, INC. (US) 2023-08-17 WO disclosed