SCHEMBL30712642

SCHEMBL30712642

O=C(O)c1cnc(-c2ccccc2)c(-c2ccccc2)n1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.66
ALOX15 P16050 2/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 1/20 0.56
CKS1B P61024 3/20 0.49
SKP1 P63208 3/20 0.49
SKP2 Q13309 3/20 0.49
LMNA P02545 1/20 0.48
NAPRT Q6XQN6 1/20 0.48
P4HTM Q9NXG6 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KDM4E B2RXH2 2/20 0.48
TSHR P16473 1/20 0.48
ACMSD Q8TDX5 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL4456253 1.00 CNR1 (0.66) CNR1ALOX15ALDH1A1HPGDHSD17B10
SCHEMBL476267 0.85 CNR1 (0.62) CNR1ALDH1A1CKS1BSKP1SKP2
SCHEMBL2834588 0.85 CNR1 (0.62) CNR1ALDH1A1CKS1BSKP1SKP2
SCHEMBL2704945 0.84 CNR1 (0.67) CNR1LMNAL3MBTL1KDM4EGAA
SCHEMBL4456962 0.84 CNR1 (0.57) CNR1ALOX15ALDH1A1HPGDHSD17B10
SCHEMBL4465958 0.84 CNR1 (0.69) CNR1
SCHEMBL2830367 0.81 CNR1 (0.61) CNR1ALDH1A1SMN1; SMN2
SCHEMBL2837164 0.81 CNR1 (0.57) CNR1CKS1BSKP1SKP2L3MBTL1
SCHEMBL30712635 0.81 CNR1 (0.61) CNR1ALDH1A1SMN1; SMN2
SCHEMBL4451106 0.80 CNR1 (1.00) CNR1ALDH1A1LMNAKDM4ETDP1

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-2024009283-A1 AT2 ANTAGONISTS FOR NON-ADDICTIVE PAIN RELIEF UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2024-01-11 WO disclosed