SCHEMBL9703191

SCHEMBL9703191

C1=C(c2nc(C3CC3)no2)CNCC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 2/20 0.52
CHRM3 P20309 2/20 0.52
CHRM2 P08172 1/20 0.52
CHRM4 P08173 1/20 0.52
CHRM5 P08912 1/20 0.52
USP7 Q93009 2/20 0.49
POLB P06746 1/20 0.43
CASP3 P42574 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA12 O43570 1/20 0.39
HTT P42858 1/20 0.35
CNR2 P34972 1/20 0.34
HTR1A P08908 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
Hydrochloric Acid SCHEMBL9724750 0.98 CHRM1 (0.51) CHRM1CHRM3CHRM2CHRM4CHRM5
Oxalic Acid SCHEMBL9704125 0.92 CHRM2 (0.46) CHRM1CHRM3CHRM2CHRM4CHRM5
Oxalic Acid SCHEMBL9704110 0.92 CHRM2 (0.46) CHRM1CHRM3CHRM2CHRM4CHRM5
Oxalic Acid SCHEMBL9404509 0.87 POLB (0.48) CHRM1CHRM3CHRM2CHRM4CHRM5
Oxalic Acid SCHEMBL9404299 0.87 POLB (0.45) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL9724619 0.76 CHRM2 (0.59) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL10518946 0.74 USP7 (0.41) USP7POLBCASP3SENP7SENP6
SCHEMBL24434496 0.73 CHRM2 (0.56) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL9724764 0.73 CHRM2 (0.56) CHRM1CHRM3CHRM2CHRM4CHRM5
SCHEMBL9724711 0.73 CHRM2 (0.52) CHRM1CHRM3CHRM2CHRM4CHRM5

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0259621-B1 PIPERIDINE COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-11-25 EP claimed
EP-0459568-A2 Substituted oxadiazoles and thiadiazoles for use in the treatment of glaucoma and novel compounds having such use MERCK SHARP & DOHME LTD. (GB) 1991-12-04 EP claimed
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP claimed
US-4837241-A TREATMENT OF ALZEHEIMER*S DISEASE A/S FERROSAN (DK) 1989-06-06 US claimed
US-5134146-A SUBSTITUTED OXADIAZOLES AND THIADIAZOLES FOR USE IN THE TREATMENT OF GLAUCOMA MERCK SHARP AND DOHME LTD. (GB) 1992-07-28 US disclosed
EP-0459568-A2 Substituted oxadiazoles and thiadiazoles for use in the treatment of glaucoma and novel compounds having such use MERCK SHARP & DOHME LTD. (GB) 1991-12-04 EP disclosed
EP-0323864-A2 Lipophilic oxadiazoles MERCK SHARP & DOHME LTD. (GB) 1989-07-12 EP disclosed