SCHEMBL9303855

SCHEMBL9303855

[CH2]CCCCCCCCCc1ccccc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.52
CHRM2 P08172 2/20 0.44
LIPG Q9Y5X9 1/20 0.40
SLC16A3 O15427 1/20 0.38
DAO P14920 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CTBP2 P56545 1/20 0.37
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
CYP19A1 P11511 1/20 0.36
TSHR P16473 1/20 0.36
ACHE P22303 1/20 0.36
MGLL Q99685 1/20 0.36
GPR84 Q9NQS5 1/20 0.36
KMT2A Q03164 1/20 0.35

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
SCHEMBL1610409 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL1610239 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL1610545 1.00 TAAR1 (0.52) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL1611321 0.98 TAAR1 (0.54) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL397691 0.91 TAAR1 (0.56) TAAR1CHRM2DAOCA12CA1
SCHEMBL27498434 0.89 TAAR1 (0.54) TAAR1CHRM2DAOCA12CA1
SCHEMBL8103734 0.89 TAAR1 (0.62) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8093093 0.89 TAAR1 (0.62) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8094982 0.89 TAAR1 (0.62) TAAR1CHRM2LIPGSLC16A3DAO
SCHEMBL8093176 0.89 TAAR1 (0.62) TAAR1CHRM2LIPGSLC16A3DAO

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-5354729-A Controlling weeds at low dosage; nonphytotoxic SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-10-11 US disclosed
EP-0579469-A2 N-acyldihydroquinoline derivatives as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-01-19 EP disclosed