SCHEMBL1758893

SCHEMBL1758893

COc1ccc(C=C(C)CO)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
KDM4E B2RXH2 4/20 0.55
MAPT P10636 2/20 0.55
HPGD P15428 2/20 0.55
CYP3A4 P08684 2/20 0.52
TSHR P16473 2/20 0.52
CYP1A2 P05177 1/20 0.52
NFKB1 P19838 1/20 0.52
APEX1 P27695 1/20 0.52
BLM P54132 1/20 0.52
PMP22 Q01453 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
NQO2 P16083 2/20 0.49
TUBB1 Q9H4B7 1/20 0.47
CYP2A6 P11509 1/20 0.47
GSK3B P49841 1/20 0.46
LMNA P02545 2/20 0.45
TP53 P04637 1/20 0.45
CYP1A1 P04798 1/20 0.44
ALOX12 P18054 1/20 0.44

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
SCHEMBL4630831 1.00 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTHPGDCYP3A4
SCHEMBL10882467 0.82 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTHPGDCYP3A4
SCHEMBL11053464 0.82 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTHPGDCYP3A4
SCHEMBL1758369 0.82 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTHPGDCYP3A4
SCHEMBL11053465 0.82 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTHPGDCYP3A4
SCHEMBL8983605 0.82 ALDH1A1 (0.53) ALDH1A1KDM4EMAPTHPGDCYP3A4
SCHEMBL8144362 0.79 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTHPGDCYP3A4
SCHEMBL11441842 0.79 ALDH1A1 (0.50) ALDH1A1KDM4EMAPTHPGDCYP3A4
Alcohol SCHEMBL9052569 0.79 TRPA1 (0.41) MAPTPTGS2TRPA1
SCHEMBL12169007 0.79 ALDH1A1 (0.63) ALDH1A1KDM4EMAPTHPGDCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1927889-B1 Lithographic printing plate precursor FUJIFILM CORP (JP) 2014-06-25 EP disclosed
EP-2496674-B1 ODORANTS WITH ANISIC NOTES FIRMENICH & CIE (CH) 2013-06-26 EP disclosed
US-8410042-B2 Odorants with anisic notes FIRMENICH SA (CH) 2013-04-02 US disclosed
EP-2496674-A1 ODORANTS WITH ANISIC NOTES Firmenich S.A. (CH) 2012-09-12 EP disclosed
US-20120208741-A1 ODORANTS WITH ANISIC NOTES FIRMENICH SA (CH) 2012-08-16 US disclosed
WO-2011051834-A1 ODORANTS WITH ANISIC NOTES FIRMENICH SA (CH) 2011-05-05 WO disclosed
EP-1927889-A1 Lithographic printing plate precursor FUJIFILM Corporation (JP) 2008-06-04 EP disclosed
EP-1091253-B1 Plate making process for planographic plate, automatic developing apparatus and recording medium FUJI PHOTO FILM CO LTD (JP) 2005-03-30 EP disclosed
EP-1091253-A2 Plate making process for planographic plate, automatic developing apparatus and recording medium FUJI PHOTO FILM CO., LTD. (JP) 2001-04-11 EP disclosed
EP-1091251-A2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2001-04-11 EP disclosed
US-4687727-A Light-sensitive planographic printing plate with layer of diazo resin containing photopolymerizable composition FUJI PHOTO FILM CO., LTD. (JP) 1987-08-18 US disclosed
US-4511645-A ALLYL METHACRYLATE-METHACRYLIC ACID COPOLYMER, CURING AGENT, PHOTOINITIATOR FUJI PHOTO FILM CO., LTD. (JP) 1985-04-16 US disclosed
EP-0104863-A2 Light-sensitive planographic printing plate FUJI PHOTO FILM CO., LTD. (JP) 1984-04-04 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-20120208741-A1 ODORANTS WITH ANISIC NOTES C1S, ACMSD, CRAT ALDH1A1 87/4885KDM4E 1421/4885MAPT 4086/4885

“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.