SCHEMBL12440889

SCHEMBL12440889

CCCCCCc1cc(C)ccc1Br

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.43
MAPT P10636 2/20 0.43
TP53 P04637 2/20 0.43
CYP3A4 P08684 2/20 0.43
HTT P42858 2/20 0.43
MEN1 O00255 1/20 0.43
ALOX5 P09917 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
LIPG Q9Y5X9 1/20 0.41
GPR84 Q9NQS5 1/20 0.39
ALDH1A1 P00352 2/20 0.37
GAA P10253 1/20 0.37
THRB P10828 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PLK1 P53350 1/20 0.37
ESR1 P03372 2/20 0.36
ADRA2A P08913 2/20 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
SCHEMBL24376119 0.92 TYR (0.40) TYRMAPTTP53CYP3A4HTT
SCHEMBL13429562 0.86 RARB (0.40) TYRMAPTTP53CYP3A4HTT
SCHEMBL7640354 0.83 MAPT (0.44) TYRMAPTTP53CYP3A4HTT
SCHEMBL27574849 0.83 TYR (0.44) TYRMAPTTP53CYP3A4HTT
SCHEMBL10639347 0.81 TAAR1 (0.57) TYRMAPTTP53CYP3A4HTT
SCHEMBL5933480 0.81 TYR (0.50) TYRMAPTTP53CYP3A4HTT
SCHEMBL30912801 0.81 TAAR1 (0.57) TYRMAPTTP53CYP3A4HTT
SCHEMBL3671257 0.81 TAAR1 (0.57) TYRMAPTTP53CYP3A4HTT
SCHEMBL3892982 0.81 TAAR1 (0.57) TYRMAPTTP53CYP3A4HTT
SCHEMBL6549903 0.81 TAAR1 (0.57) TYRMAPTTP53CYP3A4HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9318706-B2 Laminated structure, method for producing same, and electronic element comprising same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-04-19 US disclosed
US-20110177312-A1 LAMINATED STRUCTURE, METHOD FOR PRODUCING SAME, AND ELECTRONIC ELEMENT COMPRISING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-21 US disclosed
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110177312-A1 LAMINATED STRUCTURE, METHOD FOR PRODUCING SAME, AND ELECTRONIC ELEMENT COMPRISING SAME EPCAM, ITGA1, ITGB1 TYR 2235/4885MAPT 456/4885TP53 3701/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.