SCHEMBL9036006

SCHEMBL9036006

O=C(CCN1CCSC1)c1ccc(Cl)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
GSK3B P49841 1/20 0.47
HPGD P15428 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
F2 P00734 1/20 0.40
DAO P14920 1/20 0.40
GAA P10253 1/20 0.39
HTR1A P08908 2/20 0.38
POLB P06746 3/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
NPC1 O15118 1/20 0.36
TP53 P04637 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
SCHEMBL7443771 0.81 KMT2A (0.56) MAPTALDH1A1KMT2AMEN1GSK3B
SCHEMBL9034210 0.81 ALDH1A1 (0.48) MAPTALDH1A1KMT2AMEN1HPGD
SCHEMBL7432625 0.80 KMT2A (0.56) MAPTALDH1A1KMT2AMEN1GSK3B
SCHEMBL9034385 0.77 ALDH1A1 (0.61) MAPTALDH1A1KMT2AHPGDLMNA
SCHEMBL9034933 0.76 KMT2A (0.69) MAPTALDH1A1KMT2AMEN1GSK3B
Hydrochloric Acid SCHEMBL5358583 0.75 KMT2A (0.53) MAPTALDH1A1KMT2AMEN1MAPK1
SCHEMBL15988636 0.75 GSK3B (0.73) MAPTALDH1A1KMT2AMEN1GSK3B
SCHEMBL9035245 0.74 KMT2A (0.62) MAPTALDH1A1KMT2ALMNAGAA
SCHEMBL9035205 0.71 SIGMAR1 (0.54) KMT2AMEN1HTR1ANPC1TSHR
SCHEMBL9035090 0.71 KMT2A (0.59) MAPTALDH1A1KMT2AMEN1HPGD

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 5 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
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