SCHEMBL11099223

SCHEMBL11099223

O=C(O)CSc1nc2cc(Cl)ccc2s1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.65
KMT2A Q03164 4/20 0.65
MEN1 O00255 3/20 0.65
MAPT P10636 3/20 0.65
HPGD P15428 3/20 0.65
HSD17B10 Q99714 3/20 0.65
TSHR P16473 2/20 0.65
NPC1 O15118 1/20 0.65
RAB9A P51151 1/20 0.65
ALOX5 P09917 4/20 0.62
KDM4E B2RXH2 1/20 0.61
PSMD14 O00487 1/20 0.61
MMP2 P08253 1/20 0.61
GAA P10253 1/20 0.61
KCNH2 Q12809 1/20 0.61
USP2 O75604 1/20 0.61
LMNA P02545 1/20 0.61
HTT P42858 1/20 0.61
PPARA Q07869 6/20 0.60
SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL1269542 0.87 MAPT (0.66) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL11115997 0.87 KMT2A (0.66) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL10830747 0.86 ALOX5 (0.72) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL7015882 0.84 ALOX5 (0.65) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL10597312 0.83 NPC1 (0.57) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL28433164 0.83 LMNA (0.53) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL11177144 0.82 MAPT (0.58) ALDH1A1KMT2AMEN1MAPTHPGD
Benzene SCHEMBL7330438 0.82 ALOX5 (0.61) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL4678684 0.81 KMT2A (0.62) ALDH1A1KMT2AMEN1MAPTHPGD
SCHEMBL9622398 0.80 SMN1; SMN2 (0.71) ALDH1A1KMT2AMEN1MAPTHPGD

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
US-4367233-A ALPHA-PHENYL-2-/AZA/BENZOTHIAZOYLTHIOGLYCOLIC ACIDS AMERICAN HOME PRODUCTS CORPORATION (US) 1983-01-04 US claimed
EP-0021773-B1 THIAZOLO (2,3-B) BENZO (AND AZABENZO) THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AMERICAN HOME PRODUCTS CORPORATION (US) 1984-08-01 EP disclosed
EP-0006347-B1 COMPOSITIONS AND METHOD FOR REGULATING SOYBEAN PLANT GROWTH UTILIZING SUBSTITUTED BENZAZOLYLTHIOALKANOIC ACIDS MONSANTO COMPANY (US) 1984-01-25 EP disclosed
US-4367233-A ALPHA-PHENYL-2-/AZA/BENZOTHIAZOYLTHIOGLYCOLIC ACIDS AMERICAN HOME PRODUCTS CORPORATION (US) 1983-01-04 US disclosed
US-4275065-A USEFUL FOR SKIN GRAFTS AND ORGAN TRANSPLANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-06-23 US disclosed
EP-0021773-A1 Thiazolo (2,3-b) benzo (and azabenzo) thiazole derivatives, process for their preparation and pharmaceutical compositions containing them AMERICAN HOME PRODUCTS CORPORATION (US) 1981-01-07 EP disclosed