SCHEMBL12639953

SCHEMBL12639953

Cc1ccc(C=Cc2ccc(C)s2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.58
▸ PTGS2 P35354 3/20 0.58
▸ NFE2L2 Q16236 4/20 0.48
▸ MAPT P10636 3/20 0.47
▸ RAB9A P51151 3/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ SENP8 Q96LD8 1/20 0.47
▸ SENP7 Q9BQF6 1/20 0.47
▸ SENP6 Q9GZR1 1/20 0.47
▸ RELA Q04206 1/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ TUBB4A P04350 1/20 0.43
▸ TUBB P07437 1/20 0.43
▸ TUBA3C P0DPH7 1/20 0.43
▸ TUBA1B P68363 1/20 0.43
▸ TUBA4A P68366 1/20 0.43

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
SCHEMBL12600362 1.00 PTGS1 (0.58) PTGS1PTGS2NFE2L2MAPTRAB9A
SCHEMBL13788744 0.94 PTGS1 (0.63) PTGS1PTGS2NFE2L2MAPTRAB9A
SCHEMBL10037404 0.89 NFE2L2 (0.54) PTGS1PTGS2NFE2L2MAPTRAB9A
SCHEMBL13226178 0.84 MAPT (0.61) PTGS1PTGS2MAPTRAB9ANPC1
SCHEMBL12307008 0.84 MAPT (0.61) PTGS1PTGS2MAPTRAB9ANPC1
SCHEMBL14156061 0.83 NFE2L2 (0.48) PTGS1PTGS2NFE2L2MAPTRAB9A
SCHEMBL13416012 0.83 PTGS1 (0.58) PTGS1PTGS2NFE2L2MAPTRAB9A
SCHEMBL14433026 0.82 PTGS1 (0.59) PTGS1PTGS2MAPTRAB9ANPC1
SCHEMBL14156064 0.82 NFE2L2 (0.47) PTGS1PTGS2NFE2L2MAPTRAB9A
SCHEMBL18799227 0.81 RELA (0.53) PTGS1PTGS2MAPTRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383831-B2 Dye for dye-sensitized solar cell, semiconductor electrode, and dye-sensitized solar cell MITSUBISHI PAPER MILLS LIMITED (JP) 2013-02-26 — — US disclosed
US-8383831-B2 Dye for dye-sensitized solar cell, semiconductor electrode, and dye-sensitized solar cell MITSUBISHI PAPER MILLS LIMITED (JP) 2013-02-26 — — US disclosed
US-20110155241-A1 DYE FOR DYE-SENSITIZED SOLAR CELL, SEMICONDUCTOR ELECTRODE, AND DYE-SENSITIZED SOLAR CELL MITSUBISHI PAPER MILLS LIMITED (JP) 2011-06-30 — — US disclosed
US-20110155241-A1 DYE FOR DYE-SENSITIZED SOLAR CELL, SEMICONDUCTOR ELECTRODE, AND DYE-SENSITIZED SOLAR CELL MITSUBISHI PAPER MILLS LIMITED (JP) 2011-06-30 — — US disclosed
EP-2309584-A1 DYE FOR DYE-SENSITIZED SOLAR CELL, SEMICONDUCTOR ELECTRODE, AND DYE-SENSITIZED SOLAR CELL Mitsubishi Paper Mills Limited (JP) 2011-04-13 — — 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-20110155241-A1 DYE FOR DYE-SENSITIZED SOLAR CELL, SEMICONDUCTOR ELECTRODE, AND DYE-SENSITIZED SOLAR CELL CRY1, CRY2, TYR PTGS1 4092/4885PTGS2 3752/4885NFE2L2 992/4885

“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.

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