SCHEMBL17209490

SCHEMBL17209490

c1cc2c(s1)C(C1CCc3ccsc31)CC2

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 9/20 0.43
DRD2 P14416 2/20 0.40
HTR1A P08908 1/20 0.40
HTR7 P34969 1/20 0.40
DRD3 P35462 1/20 0.36

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
SCHEMBL3962987 0.77
SCHEMBL13770917 0.77
SCHEMBL13377607 0.77 TAAR1 (0.38) TAAR1DRD2HTR1AHTR7DRD3
Hydrochloric Acid SCHEMBL18424520 0.76 TAAR1 (0.43) TAAR1DRD2HTR1AHTR7
SCHEMBL13344500 0.74 TAAR1 (0.39) TAAR1DRD2HTR1AHTR7DRD3
SCHEMBL14903795 0.73 TAAR1 (0.53) TAAR1DRD2HTR1AHTR7
SCHEMBL8260730 0.71 TAAR1 (0.37) TAAR1DRD2HTR1AHTR7DRD3
SCHEMBL10653698 0.71 TAAR1 (0.37) TAAR1DRD2HTR1AHTR7
SCHEMBL13117921 0.71 TAAR1 (0.37) TAAR1DRD2HTR1AHTR7DRD3
SCHEMBL12891564 0.70 TAAR1 (0.44) TAAR1DRD2HTR1AHTR7DRD3

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-9711728-B1 Fused thiophene-based conjugated polymers and their use in optoelectronic devices NORTHWESTERN UNIVERSITY (US) 2017-07-18 US disclosed
US-9178160-B1 Fused thiophene-based conjugated polymers and their use in optoelectronic devices NORTHWESTERN UNIVERSITY (US) 2015-11-03 US disclosed