SCHEMBL9743754

SCHEMBL9743754

Clc1ccc2sc(SCCN3CCOCC3)nc2c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TMEM97 Q5BJF2 3/20 0.68
ALOX5 P09917 4/20 0.51
ALDH1A1 P00352 5/20 0.50
MAPT P10636 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
USP2 O75604 1/20 0.48
HPGD P15428 3/20 0.47
TSHR P16473 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
PSMD14 O00487 1/20 0.46
MMP2 P08253 1/20 0.46
GAA P10253 1/20 0.46
KCNH2 Q12809 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL9744032 0.91 TMEM97 (0.56) TMEM97ALDH1A1MAPTLMNANPSR1
SCHEMBL9743903 0.88 TMEM97 (0.86) TMEM97ALOX5ALDH1A1SMN1; SMN2NPSR1
SCHEMBL9742816 0.86 TMEM97 (0.50) TMEM97ALDH1A1SMN1; SMN2USP2HPGD
SCHEMBL9744708 0.83 ALOX5 (0.51) TMEM97ALOX5ALDH1A1LMNANPSR1
SCHEMBL9744829 0.82 ALDH1A1 (0.58) TMEM97ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL9216935 0.80 TMEM97 (0.44) TMEM97ALDH1A1MAPTSMN1; SMN2NPSR1
SCHEMBL9214919 0.80 USP2 (0.47) TMEM97ALDH1A1LMNANPSR1USP2
SCHEMBL24366776 0.79 DRD3 (0.54) TMEM97MEN1KMT2A
SCHEMBL30469759 0.79 DRD3 (0.54) TMEM97MEN1KMT2A
SCHEMBL81654 0.79 ALDH1A1 (0.67) TMEM97ALOX5ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5171746-A THIAZOLE AND IMIDAZOLE DERIVATIVES AND ANTIULCER COMPOSITION CONTAINING SAME MEIJI SEIKA KABUSHIKI KAISHA (JP) 1992-12-15 US disclosed
EP-0452076-A1 Thiazole and imidazole derivatives and antiulcer composition containing same MEIJI SEIKA KABUSHIKI KAISHA (JP) 1991-10-16 EP disclosed