SCHEMBL9906555

SCHEMBL9906555

CCCC1CCC(c2ccc(OC(C)CC(C)OC)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 2/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ DRD2 P14416 1/20 0.38
▸ ESR2 Q92731 3/20 0.36
▸ TSHR P16473 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ CACNA1G O43497 1/20 0.31
▸ CACNA1H O95180 1/20 0.31
▸ CACNA1I Q9P0X4 1/20 0.31
▸ CHEK2 O96017 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 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
SCHEMBL9906539 0.96 CYP2C9 (0.43) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL816535 0.92 CYP2C9 (0.39) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL815984 0.89 CYP2C9 (0.36) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL13219123 0.87 CYP2C9 (0.49) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL13219125 0.84 CYP2C9 (0.46) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL20391886 0.83 CYP2C9 (0.52) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL18306895 0.81 CYP2C9 (0.45) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL9060201 0.79 CYP2C9 (0.51) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL4801614 0.79 CYP2C9 (0.51) CYP2C9MEN1KMT2AALDH1A1LMNA
SCHEMBL13845274 0.78 CYP2C9 (0.48) CYP2C9MEN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2110390-B1 POLYMERIZABLE COMPOSITION ADEKA CORP (JP) 2014-07-02 — — EP disclosed
US-8197710-B2 Polymerizable compound and polymerizable composition ADEKA CORPORATION (JP) 2012-06-12 — — US disclosed
US-8066906-B2 Polymerizable compound and polymerizable composition ADEKA CORPORATION (JP) 2011-11-29 — — US disclosed
US-7981320-B2 Polymerizable composition ADEKA CORPORATION (JP) 2011-07-19 — — US disclosed
US-7931825-B2 Polymerizable composition ADEKA CORPORATION (JP) 2011-04-26 — — US disclosed
US-7919009-B2 Polymerizable compounds and polymerizable compositions ADEKA CORPORATION (JP) 2011-04-05 — — US disclosed
US-7910021-B2 Polymerizable optical active compound and polymerizable composition containing the same ADEKA CORPORATION (JP) 2011-03-22 — — US disclosed
US-20100320419-A1 POLYMERIZABLE COMPOUND AND POLYMERIZABLE COMPOSITION ADEKA CORPORATION (JP) 2010-12-23 — — US disclosed
US-20100294990-A1 POLYMERIZABLE COMPOUND AND POLYMERIZABLE COMPOSITION ADEKA CORPORATION (JP) 2010-11-25 — — US disclosed
US-20100090163-A1 POLYMERIZABLE COMPOSITION ADEKA CORPORATION (JP) 2010-04-15 — — US disclosed
US-7683203-B2 Polymerizable compound and composition containing the polymerizable compound ADEKA CORPORATION (JP) 2010-03-23 — — US disclosed
US-7683203-B2 Polymerizable compound and composition containing the polymerizable compound ADEKA CORPORATION (JP) 2010-03-23 — — US disclosed
US-20100032621-A1 POLYMERIZABLE COMPOUNDS AND POLYMERIZABLE COMPOSITIONS ADEKA CORPORATION (JP) 2010-02-11 — — US disclosed
US-20100032620-A1 POLYMERIZABLE OPTICAL ACTIVE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING THE SAME ADEKA CORPORATION (JP) 2010-02-11 — — US disclosed
US-20090294730-A1 POLYMERIZABLE COMPOSITION ADEKA CORPORATION (JP) 2009-12-03 — — US disclosed
US-20090137761-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND HAVING FUSED RING AND HOMO- AND COPOLYMER OF THE POLYMERIZABLE LIQUID CRYSTAL COMPOUND ADEKA CORPORATION (JP) 2009-05-28 — — US disclosed
US-20070282087-A1 Polymerizable Compound And Composition Containing The Polymerizable Compound ADEKA CORPORATION (JP) 2007-12-06 — — 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 (6 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-20100320419-A1 POLYMERIZABLE COMPOUND AND POLYMERIZABLE COMPOSITION NOS1, NOS2, PYM1 CYP2C9 248/4885MEN1 503/4885KMT2A 2646/4885
US-20090137761-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOUND HAVING FUSED RING AND HOMO- AND COPOLYMER OF THE POLYMERIZABLE LIQUID CRYSTAL COMPOUND CCNL2, PYM1, NLK CYP2C9 1567/4885MEN1 2131/4885KMT2A 2320/4885
US-20100032620-A1 POLYMERIZABLE OPTICAL ACTIVE COMPOUND AND POLYMERIZABLE COMPOSITION CONTAINING THE SAME C1S, PYM1, MCCC2 CYP2C9 1814/4885MEN1 360/4885KMT2A 3291/4885
US-20100294990-A1 POLYMERIZABLE COMPOUND AND POLYMERIZABLE COMPOSITION PYM1, SCO2, ZYX CYP2C9 1146/4885MEN1 255/4885KMT2A 1150/4885
US-20100032621-A1 POLYMERIZABLE COMPOUNDS AND POLYMERIZABLE COMPOSITIONS CHRM1, CHRM2, CCNE1 CYP2C9 799/4885MEN1 95/4885KMT2A 2784/4885
US-20090294730-A1 POLYMERIZABLE COMPOSITION SCO2, NAT1, CORO1C CYP2C9 688/4885MEN1 282/4885KMT2A 1092/4885

“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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