SCHEMBL1610683

SCHEMBL1610683

[CH2]CCCCCCCc1cc(C)ccc1C

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.55
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 2/20 0.36
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
HTT P42858 2/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 1/20 0.32
TP53 P04637 1/20 0.32
TRAP1 Q12931 1/20 0.32
TACR1 P25103 1/20 0.32
AMY1A P0DUB6 1/20 0.32
NR3C1 P04150 1/20 0.31
NR3C2 P08235 1/20 0.31

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
SCHEMBL1611851 1.00 TAAR1 (0.55) TAAR1NPC1RAB9APOLBALDH1A1
SCHEMBL1610404 1.00 TAAR1 (0.55) TAAR1NPC1RAB9APOLBALDH1A1
SCHEMBL1612323 0.98 TAAR1 (0.57) TAAR1NPC1RAB9APOLBALDH1A1
SCHEMBL1610116 0.92 TAAR1 (0.59) TAAR1NPC1RAB9APOLBALDH1A1
SCHEMBL1609537 0.85 PYCR1 (0.38) TAAR1NPC1RAB9AALDH1A1TDP1
SCHEMBL1611184 0.85 PYCR1 (0.38) TAAR1NPC1RAB9AALDH1A1TDP1
SCHEMBL1611672 0.85 PYCR1 (0.38) TAAR1NPC1RAB9AALDH1A1TDP1
SCHEMBL315721 0.84 TAAR1 (0.63) TAAR1NPC1RAB9APOLBALDH1A1
SCHEMBL1610293 0.82 PYCR1 (0.39) TAAR1NPC1RAB9AALDH1A1TDP1
SCHEMBL6549903 0.82 TAAR1 (0.57) TAAR1ALDH1A1TDP1HTTGAA

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-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 TAAR1 772/4885NPC1 3543/4885RAB9A 3050/4885

“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.