SCHEMBL10425283

SCHEMBL10425283

O=CN1[C@@H](c2cccnc2)SC[C@H]1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.52
▸ KDM4E B2RXH2 1/20 0.52
▸ MAPT P10636 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.39

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
SCHEMBL9740818 1.00 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTHSD17B10
SCHEMBL9250005 0.82 ALDH1A1 (0.54) ALDH1A1KDM4EMAPT
SCHEMBL9250009 0.82 ALDH1A1 (0.54) ALDH1A1KDM4EMAPT
SCHEMBL9853982 0.81 KDM4E (0.45) ALDH1A1KDM4E
SCHEMBL27314597 0.80 ALDH1A1 (0.45) ALDH1A1KDM4EMAPT
SCHEMBL9853999 0.80 POLB (0.58) ALDH1A1KDM4EHSD17B10
Acetic Acid SCHEMBL9854087 0.79 POLB (0.57) ALDH1A1KDM4EHSD17B10
SCHEMBL9647783 0.78 PTAFR (0.56) —
SCHEMBL9268772 0.78 — —
SCHEMBL10647450 0.77 PTAFR (0.64) ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1029382-A — — None — — JP disclosed
US-4906757-A Process for the preparation of dextrorotatory 3-(3-pyridyl)-1H,3H-pyrrolo [1,2-c]-7-thiazolecarboxylic acid RHONE-POULENC SANTE (FR) 1990-03-06 — — US disclosed
US-4786645-A ANTIALLERGENS, ANTIINFLAMMATORY RHONE-POULENC SANTE (FR) 1988-11-22 — — US disclosed
US-4783472-A 1H,3H-pyrrol[1,2-c]thiazole derivatives and pharmaceutical compositions containing them RHONE-POULENC SANTE (FR) 1988-11-08 — — US disclosed
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