SCHEMBL9825516

SCHEMBL9825516

O=C(CN1CSCC1=O)Nc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.61
TP53 P04637 2/20 0.54
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
TSHR P16473 1/20 0.49
ALDH1A1 P00352 8/20 0.48
HSD17B10 Q99714 1/20 0.48
NPC1 O15118 2/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
G6PD P11413 1/20 0.47
RAB9A P51151 1/20 0.47
MAOB P27338 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL9825395 0.84 DRD2 (0.48) MEN1KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL9826999 0.80 MAPT (0.53) HTTTSHRALDH1A1LMNAKDM4E
SCHEMBL11391291 0.76 HTT (1.00) HTTTP53MEN1KMT2ATSHR
SCHEMBL5457230 0.73 ALDH1A1 (0.78) HTTMEN1KMT2ATSHRALDH1A1
SCHEMBL9825290 0.73 KMT2A (0.43) MEN1KMT2ATSHRLMNA
SCHEMBL6796523 0.71 NPC1 (0.70) HTTTP53MEN1KMT2AALDH1A1
SCHEMBL6893687 0.71 ALDH1A1 (0.79) TP53MEN1KMT2AALDH1A1NPC1
SCHEMBL9826578 0.70 ALDH1A1 (0.60) HTTTSHRALDH1A1HSD17B10KDM4E
SCHEMBL12177294 0.69 ALDH1A1 (0.69) HTTTP53MEN1KMT2ATSHR
SCHEMBL11147683 0.68 ALDH1A1 (0.90) HTTTP53MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203743-B1 OXOTHIAZOLIDINE COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed
US-4764514-A COGNITIONACTIVATORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-08-16 US disclosed
EP-0203743-A1 Oxothiazolidine compound FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-03 EP disclosed