SCHEMBL9036688

SCHEMBL9036688

COC(=O)C1NCSC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.40
ARG1 P05089 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA7 P36544 1/20 0.32

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
SCHEMBL14570178 1.00 KMT2A (0.40) KMT2AARG1CHRNB2CHRNA4CHRNB4
SCHEMBL6432107 0.81 KMT2A (0.38) KMT2AARG1CHRNB2CHRNA4CHRNB4
SCHEMBL6432101 0.81 KMT2A (0.38) KMT2AARG1CHRNB2CHRNA4CHRNB4
SCHEMBL15046738 0.81 KMT2A (0.38) KMT2AARG1CHRNB2CHRNA4CHRNB4
SCHEMBL2425461 0.80 MAPK1 (0.34)
SCHEMBL6161938 0.80 MAPK1 (0.34)
SCHEMBL9645913 0.80 LMNA (0.36) KMT2A
SCHEMBL2425462 0.80 MAPK1 (0.34)
SCHEMBL9645916 0.80 LMNA (0.36) KMT2A
SCHEMBL13534665 0.79

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
WO-2017060914-A2 PENICILLAMINE AND ITS DERIVATIVES ARE USED IN THE TREATMENT OF COPPER TOXICITY AND NASH Krisani Biosciences (P) Ltd. (IN) 2017-04-13 WO disclosed
EP-0411775-B1 Heterocyclic compounds containing nitrogen and sulfur, processes for their preparation and pharmaceutical compositions thereof RICHTER GEDEON VEGYESZET (HU) 1996-03-13 EP disclosed
CN-1028229-C Heterocyclic compounds containing nitrogen and sulfur, pharmaceutical composition containing same and process for preparing them RICHTER GEDEON VEGYESZET (HU) 1995-04-19 CN disclosed
US-5096902-A Cerebral antihypoxic action, senile dememtia, Alzheimer's, cognitive functions RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1992-03-17 US disclosed
CN-1049159-A The heterogeneous ring compound of new nitrogenous and sulphur, the method that contains the pharmaceutical composition of this compounds and prepare them RICHTER GEDEON VEGYESZET (HU) 1991-02-13 CN disclosed
EP-0411775-A1 Heterocyclic compounds containing nitrogen and sulfur, processes for their preparation and pharmaceutical compositions thereof RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1991-02-06 EP disclosed
US-4283407-A ANTIHYPERTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-08-11 US disclosed