SCHEMBL10452902

SCHEMBL10452902

CCC(CC)CCCOCC1CO1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.65
SMN1; SMN2 Q16637 1/20 0.63
TSHR P16473 2/20 0.61
TDP1 Q9NUW8 1/20 0.59
MAPK1 P28482 1/20 0.41
CYP3A4 P08684 3/20 0.36
PDK1 Q15118 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.31
TP53 P04637 1/20 0.30

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
SCHEMBL16946589 0.93 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1
SCHEMBL11983813 0.89 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1
SCHEMBL18863120 0.86 ALDH1A1 (0.77) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1
SCHEMBL6687414 0.84 ALDH1A1 (0.88) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1
SCHEMBL27521802 0.84 SMN1; SMN2 (0.61) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1
SCHEMBL8455846 0.82 ALDH1A1 (0.80) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL27958345 0.82 TSHR (0.75) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1
SCHEMBL27705825 0.82 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1
SCHEMBL7102961 0.81 ALDH1A1 (0.83) ALDH1A1SMN1; SMN2TSHRTDP1CYP3A4
SCHEMBL10585663 0.81 TSHR (0.65) ALDH1A1SMN1; SMN2TSHRTDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411439-B1 PREPEGS AND MOLDED BODIES PRODUCED THEREOF AT LOW TEMPERATURE EVONIK DEGUSSA GMBH (DE) 2016-11-16 EP claimed
EP-2520579-B1 A silicone compound, photocurable liquid ink using the silicone compound, and method of manufacturing the ink RICOH CO LTD (JP) 2015-08-05 EP disclosed
US-8871861-B2 Silicone compound, photocurable liquid ink using the silicone compound, and method of manufacturing the ink RICOH COMPANY, LTD. (JP) 2014-10-28 US disclosed
US-20120283378-A1 A SILICONE COMPOUND, PHOTOCURABLE LIQUID INK USING THE SILICONE COMPOUND, AND METHOD OF MANUFACTURING THE INK RICOH COMPANY, LTD., (JP) 2012-11-08 US disclosed
EP-2520579-A2 A silicone compound, photocurable liquid ink using the silicone compound, and method of manufacturing the ink Ricoh Company, Ltd. (JP) 2012-11-07 EP disclosed
EP-0401502-A1 Glass-filled poly(arylene sulphide) compositions PHILLIPS PETROLEUM COMPANY (US) 1990-12-12 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-20120283378-A1 A SILICONE COMPOUND, PHOTOCURABLE LIQUID INK USING THE SILICONE COMPOUND, AND METHOD OF MANUFACTURING THE INK DOT1L, L3MBTL3, KDM7A ALDH1A1 2204/4885SMN1; SMN2 657/4885TSHR 3732/4885

“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.