SCHEMBL10697290

SCHEMBL10697290

C#CCN1CCC(c2csc(N)n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAOB P27338 9/20 0.37
MAOA P21397 6/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL5186871 0.78 DRD2 (0.46) RAB9AMAPTKDM4E
SCHEMBL2657694 0.77 RAB9A (0.41) RAB9AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL10698716 0.77 MAPT (0.44) RAB9AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL10697176 0.76 MAPT (0.43) RAB9AMAPTKDM4E
SCHEMBL965277 0.76
SCHEMBL2374371 0.72 RAB9A (0.53) RAB9AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL1794807 0.72 SMN1; SMN2 (0.53) RAB9AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL1801634 0.71 HSD17B10 (0.51) RAB9AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL21275501 0.71 RAB9A (0.43) RAB9AMAPTSMN1; SMN2KDM4EGAA
SCHEMBL10697144 0.70 ALDH1A1 (0.47) KDM4EGAAALOX15LMNA

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-0280873-A1 Piperidines, medicines containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1988-09-07 EP disclosed