SCHEMBL1610179

SCHEMBL1610179

CC/C=[C]\c1ccc(C)cc1C

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.33
PYCR1 P32322 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADRA2A P08913 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2A6 P11509 2/20 0.31
TAAR1 Q96RJ0 1/20 0.31
RAPGEF4 Q8WZA2 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
SCHEMBL1610737 0.85 TP53 (0.33) TDP1TP53SMN1; SMN2PYCR1MEN1
SCHEMBL1612595 0.84 GRM5 (0.36) TDP1TP53MEN1KMT2AALDH1A1
SCHEMBL1610600 0.82 PDE5A (0.35) TDP1TP53ALDH1A1
SCHEMBL1610562 0.80 TLR8 (0.33) TDP1TP53ALDH1A1CYP1A2CYP2A6
SCHEMBL1610580 0.79 CNR1 (0.33) TDP1TP53ALDH1A1
SCHEMBL1611056 0.77 TDP1 (0.39) TDP1TP53SMN1; SMN2PYCR1MEN1
SCHEMBL1610358 0.76
SCHEMBL1611529 0.75 TSHR (0.46) TDP1CYP3A4ALDH1A1TAAR1
SCHEMBL1612117 0.73
SCHEMBL1610960 0.72 RAPGEF4 (0.32) KMT2ARAPGEF4

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 TDP1 2129/4885TP53 1684/4885SMN1; SMN2 3123/4885

“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.