SCHEMBL11057788

SCHEMBL11057788

O=C1CCSC(c2cccnc2)N1Cc1ccc(Cl)cc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.65
ALDH1A1 P00352 2/20 0.65
TDP1 Q9NUW8 1/20 0.65
POLB P06746 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
P2RX7 Q99572 1/20 0.41

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
SCHEMBL11055589 0.89 MAPT (0.81) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11052996 0.81 ALDH1A1 (0.60) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11060554 0.78 TDP1 (0.54) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11060796 0.76 MAPT (0.79) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11118545 0.74 MAPT (0.54) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11486443 0.73 TDP1 (0.47) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11054521 0.73 ALDH1A1 (0.53) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11060611 0.71 ALDH1A1 (0.48) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11057983 0.71 MAPT (0.54) MAPTALDH1A1TDP1POLBNPSR1
SCHEMBL11052630 0.71 MAPT (0.70) MAPTALDH1A1TDP1POLBNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4482712-A FUNGICIDES; HERBICIDES; PLANT GROWTH REGULATORS ELI LILLY AND COMPANY (US) 1984-11-13 US claimed
EP-0010420-B1 PYRIDYL-SUBSTITUTED THIAZOLIDINE AND 1,3-THIAZINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AGRICULTURAL COMPOSITIONS CONTAINING SAID DERIVATIVES AND METHODS FOR REGULATING PLANT GROWTH AND PROTECTING PLANTS FROM FUNGI ELI LILLY AND COMPANY (US) 1984-08-22 EP claimed
EP-0010420-A1 Pyridyl-substituted thiazolidine and 1,3-thiazine derivatives, processes for their preparation, agricultural compositions containing said derivatives and methods for regulating plant growth and protecting plants from fungi ELI LILLY AND COMPANY (US) 1980-04-30 EP claimed
US-4482712-A FUNGICIDES; HERBICIDES; PLANT GROWTH REGULATORS ELI LILLY AND COMPANY (US) 1984-11-13 US disclosed
EP-0010420-B1 PYRIDYL-SUBSTITUTED THIAZOLIDINE AND 1,3-THIAZINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AGRICULTURAL COMPOSITIONS CONTAINING SAID DERIVATIVES AND METHODS FOR REGULATING PLANT GROWTH AND PROTECTING PLANTS FROM FUNGI ELI LILLY AND COMPANY (US) 1984-08-22 EP disclosed
US-4436739-A FUNGICIDES ELI LILLY AND COMPANY (US) 1984-03-13 US disclosed
EP-0010420-A1 Pyridyl-substituted thiazolidine and 1,3-thiazine derivatives, processes for their preparation, agricultural compositions containing said derivatives and methods for regulating plant growth and protecting plants from fungi ELI LILLY AND COMPANY (US) 1980-04-30 EP disclosed