SCHEMBL1610489

SCHEMBL1610489

CCC/C=[C]\c1cc(C)ccc1C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.34
FFAR1 O14842 1/20 0.34
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32

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
SCHEMBL1611559 0.89 PDE5A (0.35) GRM5FFAR1ALDH1A1TDP1TAAR1
SCHEMBL1612160 0.88 CNR1 (0.33) GRM5FFAR1ALDH1A1TDP1TAAR1
SCHEMBL1611405 0.86 CNR1 (0.35) GRM5FFAR1ALDH1A1TDP1
SCHEMBL1610737 0.85 TP53 (0.33) TDP1
SCHEMBL1612595 0.85 GRM5 (0.36) GRM5FFAR1ALDH1A1TDP1TAAR1
SCHEMBL1611019 0.78
SCHEMBL1612130 0.77 TSHR (0.43) GRM5FFAR1ALDH1A1
SCHEMBL1609895 0.76
SCHEMBL1610600 0.75 PDE5A (0.35) ALDH1A1TDP1
SCHEMBL1609399 0.74 TDP1 (0.39) GRM5FFAR1ALDH1A1TDP1TAAR1

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 GRM5 3485/4885FFAR1 4079/4885ALDH1A1 137/4885

“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.