SCHEMBL9035744

SCHEMBL9035744

Cc1csc(C(=O)CCN2CCSC2)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.41
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 4/20 0.34
HTT P42858 1/20 0.34
CCR2 P41597 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2D6 P10635 2/20 0.34
GSK3B P49841 3/20 0.33
HTR1A P08908 3/20 0.33
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
CYP2C9 P11712 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL15979699 0.75 DAO (0.63) DAOKMT2AMEN1ALDH1A1GSK3B
SCHEMBL9034933 0.75 KMT2A (0.69) KMT2AMEN1ALDH1A1HTTCYP1A2
SCHEMBL9034210 0.72 ALDH1A1 (0.48) KMT2AMEN1ALDH1A1HTTCYP1A2
SCHEMBL9036006 0.71 MAPT (0.51) DAOKMT2AMEN1ALDH1A1GSK3B
SCHEMBL28474265 0.71 DAO (0.57) DAOKMT2AMEN1ALDH1A1GSK3B
SCHEMBL9035245 0.70 KMT2A (0.62) KMT2AALDH1A1HTR1ALMNAMAPT
SCHEMBL2773258 0.70 DAO (0.55) DAOGSK3BMAPT
SCHEMBL3867877 0.70 DAO (0.55) DAOKMT2AMEN1ALDH1A1GSK3B
SCHEMBL6917802 0.70 DAO (0.60) DAOKMT2AMEN1ALDH1A1HTT
SCHEMBL9036692 0.69 HTT (0.55) KMT2AMEN1ALDH1A1HTTCYP1A2

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 6 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
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
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