SCHEMBL8635127

SCHEMBL8635127

N#CC=NN1CCS(=O)(=O)CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 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
SCHEMBL14609687 0.75 CTSL (0.39) RAB9A
SCHEMBL8638544 0.70
SCHEMBL30748985 0.62 CTSL (0.48) RAB9A
SCHEMBL209495 0.60
SCHEMBL12551017 0.60 ALDH1A1 (0.62)
SCHEMBL14000827 0.59 RAB9A (0.36) RAB9A
Hydrochloric Acid SCHEMBL28503994 0.58 RAB9A (0.38) RAB9A
SCHEMBL12360476 0.58 RAB9A (0.43) RAB9A
SCHEMBL661740 0.58
SCHEMBL14824038 0.58 DRD3 (0.35)

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-0687258-B1 SUBSTITUTED IMINOACETONITRILES WITH MYOCARDIAL PROTECTIVE EFFECT HOECHST AG (DE) 1998-07-22 EP disclosed