SCHEMBL11540705

SCHEMBL11540705

S=C=NC1CCCc2ccsc21

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 9/20 0.38
HTR1A P08908 1/20 0.31
DRD2 P14416 1/20 0.31
HTR7 P34969 1/20 0.31
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL11543517 0.84 TAAR1 (0.38) TAAR1HTR1ADRD2HTR7SIGMAR1
SCHEMBL11495156 0.75 ADRA2A (0.39)
SCHEMBL3541769 0.70 IDO1 (0.45) TAAR1HTR1A
SCHEMBL4794631 0.70 IDO1 (0.45) TAAR1HTR1A
SCHEMBL3541909 0.70 IDO1 (0.45) TAAR1HTR1A
SCHEMBL12891564 0.68 TAAR1 (0.44) TAAR1HTR1ADRD2HTR7SIGMAR1
SCHEMBL6647596 0.68 TAAR1 (0.47) TAAR1HTR1ADRD2HTR7SIGMAR1
SCHEMBL12891560 0.68 TAAR1 (0.44) TAAR1HTR1ADRD2HTR7SIGMAR1
SCHEMBL16545200 0.68 TAAR1 (0.44) TAAR1HTR1ADRD2HTR7SIGMAR1
SCHEMBL2923368 0.68 TAAR1 (0.44) TAAR1HTR1ADRD2HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4154740-A HERBICIDES, ANIMAL GROWTH REGULATORS AMERICAN CYANAMID COMPANY (US) 1979-05-15 US disclosed