SCHEMBL14180960

SCHEMBL14180960

O=c1n(CC(O)COCc2ccoc2)nc2c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)cnn12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 4/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.36
▸ MAPK1 P28482 3/20 0.36
▸ GAA P10253 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ HTT P42858 2/20 0.36
▸ USP2 O75604 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ GABRP O00591 1/20 0.34
▸ GABRD O14764 1/20 0.34
▸ GABRA1 P14867 1/20 0.34
▸ GABRB1 P18505 1/20 0.34
▸ GABRG2 P18507 1/20 0.34
▸ GABRB3 P28472 1/20 0.34
▸ GABRA5 P31644 1/20 0.34
▸ GABRA3 P34903 1/20 0.34
▸ GABRA2 P47869 1/20 0.34
▸ GABRB2 P47870 1/20 0.34
▸ GABRA4 P48169 1/20 0.34
▸ GABRE P78334 1/20 0.34

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
SCHEMBL4805929 0.84 CNR1 (0.47) CNR1SMN1; SMN2MAPK1GAARAB9A
SCHEMBL14180756 0.83 CNR1 (0.46) CNR1SMN1; SMN2RAB9ANPSR1LMNA
SCHEMBL14180961 0.82 CNR1 (0.48) CNR1SMN1; SMN2RAB9ANPSR1LMNA
SCHEMBL14180963 0.82 CNR1 (0.48) CNR1SMN1; SMN2RAB9ANPSR1LMNA
SCHEMBL14180939 0.80 CNR1 (0.47) CNR1SMN1; SMN2RAB9ANPSR1LMNA
SCHEMBL14180951 0.79 CNR1 (0.48) CNR1SMN1; SMN2RAB9ANPSR1LMNA
SCHEMBL14180949 0.79 CNR1 (0.47) CNR1SMN1; SMN2MAPK1RAB9AHTT
SCHEMBL14180952 0.78 CNR1 (0.47) CNR1SMN1; SMN2MAPK1LMNAKDM4E
SCHEMBL4803516 0.77 CNR1 (0.49) CNR1SMN1; SMN2RAB9AKDM4EMAPT
SCHEMBL14180958 0.77 CNR1 (0.46) CNR1SMN1; SMN2MAPK1HTTUSP2

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
US-7378418-B2 Azabicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 — — US disclosed
US-7378418-B2 Azabicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 — — US disclosed
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