SCHEMBL9035245

SCHEMBL9035245

O=C(CCN1CCSC1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.62
ALDH1A1 P00352 6/20 0.62
GFER P55789 1/20 0.60
MAPT P10636 2/20 0.59
SIGMAR1 Q99720 2/20 0.55
HTR1A P08908 5/20 0.52
LMNA P02545 1/20 0.52
GAA P10253 1/20 0.52
SLC6A4 P31645 1/20 0.51
SLC6A3 Q01959 1/20 0.51

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
SCHEMBL9036283 0.91 ALDH1A1 (0.52) KMT2AALDH1A1GFERMAPTSIGMAR1
SCHEMBL31093179 0.90 KMT2A (0.71) KMT2AALDH1A1GFERMAPTSIGMAR1
SCHEMBL9035205 0.85 SIGMAR1 (0.54) KMT2ASIGMAR1HTR1ASLC6A4SLC6A3
SCHEMBL9034385 0.85 ALDH1A1 (0.61) KMT2AALDH1A1MAPTSIGMAR1HTR1A
SCHEMBL9035090 0.85 KMT2A (0.59) KMT2AALDH1A1GFERMAPTSIGMAR1
SCHEMBL9036691 0.84 ALDH1A1 (0.55) KMT2AALDH1A1GFERMAPTLMNA
SCHEMBL9035786 0.83 ALDH1A1 (0.57) KMT2AALDH1A1GFERMAPTSIGMAR1
SCHEMBL9035735 0.81 ALDH1A1 (0.42) KMT2AALDH1A1GFERMAPTLMNA
SCHEMBL16026463 0.81 KMT2A (0.83) KMT2AALDH1A1GFERMAPTSIGMAR1
SCHEMBL9035941 0.80 KMT2A (0.51) KMT2AALDH1A1GFERMAPTHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-5096902-A Cerebral antihypoxic action, senile dememtia, Alzheimer's, cognitive functions RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1992-03-17 US claimed
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 claimed
JP-3048670-A None JP 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
US-5096902-A Cerebral antihypoxic action, senile dememtia, Alzheimer's, cognitive functions RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1992-03-17 US disclosed
JP-H0348670-A NITROGEN AND SULFUR CONTAINING HETEROCYCLIC COMPOUND RICHTER GEDEON V G RT 1991-03-01 JP 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