SCHEMBL12558192

SCHEMBL12558192

COP(=S)(OC)Oc1ccc(C)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 4/20 0.56
▸ LMNA P02545 4/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ HSD17B10 Q99714 3/20 0.56
▸ MAPK1 P28482 2/20 0.56
▸ TP53 P04637 1/20 0.56
▸ THRB P10828 1/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ TSHR P16473 3/20 0.53
▸ ACHE P22303 2/20 0.48
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ RELA Q04206 1/20 0.39
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ TEAD4 Q15561 1/20 0.37
▸ TDP1 Q9NUW8 1/20 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
SCHEMBL258632 0.88 CYP3A4 (0.58) CYP3A4LMNAALDH1A1HSD17B10MAPK1
SCHEMBL14678662 0.85 ALDH1A1 (0.51) CYP3A4LMNAALDH1A1HSD17B10MAPK1
SCHEMBL5850251 0.80 CYP3A4 (0.50) CYP3A4LMNAALDH1A1HSD17B10MAPK1
SCHEMBL1605116 0.80 MEN1 (0.50) CYP3A4LMNAALDH1A1SMN1; SMN2TSHR
SCHEMBL258335 0.80 MEN1 (0.50) CYP3A4LMNAALDH1A1SMN1; SMN2TSHR
SCHEMBL11477739 0.80 LMNA (0.55) CYP3A4LMNAALDH1A1HSD17B10MAPK1
SCHEMBL10455273 0.79 LMNA (0.53) CYP3A4LMNAALDH1A1HSD17B10MAPK1
SCHEMBL6692402 0.79 CYP3A4 (0.54) CYP3A4LMNAALDH1A1HSD17B10MAPK1
SCHEMBL1691989 0.79 CYP3A4 (0.54) CYP3A4LMNAALDH1A1HSD17B10MAPK1
Temefos SCHEMBL23303378 0.78 LMNA (0.53) CYP3A4LMNAALDH1A1HSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110142717-A1 EMISSIVE SENSORS AND DEVICES INCORPORATING THESE SENSORS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2011-06-16 — — 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-20110142717-A1 EMISSIVE SENSORS AND DEVICES INCORPORATING THESE SENSORS PAXBP1, PAX3, MTAP CYP3A4 2546/4885LMNA 1173/4885ALDH1A1 4384/4885

“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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