SCHEMBL20164916

SCHEMBL20164916

CCCCC[C@H](CO)Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.55
LMNA P02545 1/20 0.53
TRPA1 O75762 1/20 0.47
CNR2 P34972 1/20 0.46
ALDH1A1 P00352 1/20 0.44
MMP2 P08253 9/20 0.42
MMP1 P03956 4/20 0.42
MMP3 P08254 4/20 0.42
PPARA Q07869 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41

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
SCHEMBL111455 1.00 CSNK1E (0.55) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL9665073 0.98 CSNK1E (0.58) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL9280760 0.98 CSNK1E (0.58) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL10965122 0.98 CSNK1E (0.58) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL9747683 0.98 CSNK1E (0.58) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL17027839 0.98 CSNK1E (0.58) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL10521595 0.98 CSNK1E (0.58) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL10519442 0.98 CSNK1E (0.58) CSNK1ELMNATRPA1CNR2ALDH1A1
SCHEMBL14780164 0.89 CSNK1E (0.57) CSNK1ECNR2MMP2MMP1MMP3
SCHEMBL8093653 0.89 CSNK1E (0.57) CSNK1ECNR2MMP2MMP1MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3547992-A1 MIXTURES COMPRISING A PHENYL ALKANOL AND A LINEAR ALCOHOL WITH 8 TO 12 CARBON ATOMS Symrise AG (DE) 2019-10-09 EP claimed
WO-2018100018-A1 MIXTURES COMPRISING A PHENYL ALKANOL AND A LINEAR ALCOHOL WITH 8 TO 12 CARBON ATOMS SYMRISE AG (DE) 2018-06-07 WO claimed
WO-2018099580-A1 MIXTURES COMPRISING PHENYL ALKANOL AND LINEAR ALCOHOL SYMRISE AG (DE) 2018-06-07 WO claimed
EP-4376798-A1 PRESERVATIVES FOR COSMETIC AND PHARMACEUTICAL COMPOSITIONS Sachem, Inc. (US) 2024-06-05 EP disclosed
EP-4308286-A1 ACTIVE SUBSTANCE CAPSULES Symrise AG (DE) 2024-01-24 EP disclosed
WO-2023009849-A1 PRESERVATIVES FOR COSMETIC AND PHARMACEUTICAL COMPOSITIONS SACHEM, INC. (US) 2023-02-02 WO disclosed
EP-3547992-A1 MIXTURES COMPRISING A PHENYL ALKANOL AND A LINEAR ALCOHOL WITH 8 TO 12 CARBON ATOMS Symrise AG (DE) 2019-10-09 EP disclosed
WO-2018100018-A1 MIXTURES COMPRISING A PHENYL ALKANOL AND A LINEAR ALCOHOL WITH 8 TO 12 CARBON ATOMS SYMRISE AG (DE) 2018-06-07 WO disclosed
WO-2018099580-A1 MIXTURES COMPRISING PHENYL ALKANOL AND LINEAR ALCOHOL SYMRISE AG (DE) 2018-06-07 WO disclosed
US-20180140522-A1 USE OF CITRIC ACID ESTERS AS CORROSION INHIBITOR IN ALCOHOLIC COSMETIC COMPOSITIONS THAT CAN BE SPRAYED AS AN AEROSOL HENKEL AG & CO. KGAA (DE) 2018-05-24 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-20180140522-A1 USE OF CITRIC ACID ESTERS AS CORROSION INHIBITOR IN ALCOHOLIC COSMETIC COMPOSITIONS THAT CAN BE SPRAYED AS AN AEROSOL CS, ADH1C, ADH1A CSNK1E 1020/4885LMNA 4808/4885TRPA1 2058/4885

“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.