SCHEMBL4966112

SCHEMBL4966112

C=CCc1cccc(O)c1-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.50
GABRB2 P47870 3/20 0.50
AKR1B1 P15121 2/20 0.50
AURKA O14965 1/20 0.42
DAPK3 O43293 1/20 0.42
MAP4K4 O95819 1/20 0.42
RET P07949 1/20 0.42
IGF1R P08069 1/20 0.42
MET P08581 1/20 0.42
PIM1 P11309 1/20 0.42
LTK P29376 1/20 0.42
KDR P35968 1/20 0.42
MAPK8 P45983 1/20 0.42
MAPK9 P45984 1/20 0.42
CDK8 P49336 1/20 0.42
CLK2 P49760 1/20 0.42
CDK9 P50750 1/20 0.42
CDK5 Q00535 1/20 0.42
ACVR1 Q04771 1/20 0.42
PTK2 Q05397 1/20 0.42

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
Sulfuric Acid SCHEMBL8929825 0.92 AKR1B1 (0.44) GABRA1GABRB2AKR1B1AURKADAPK3
SCHEMBL7556444 0.87 GABRA1 (0.48) GABRA1GABRB2AKR1B1AURKADAPK3
SCHEMBL28552471 0.87 GABRA1 (0.59) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL30443762 0.87 GABRA1 (0.59) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL27806692 0.86 GABRA1 (0.50) GABRA1GABRB2AKR1B1AURKADAPK3
SCHEMBL13978637 0.81 AKR1B1 (0.70) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL11667000 0.81 AKR1B1 (0.53) GABRA1GABRB2AKR1B1MEN1KMT2A
2-Allylphenol SCHEMBL28139109 0.81 GABRA1 (0.55) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL11666999 0.80 GABRA1 (0.61) GABRA1GABRB2AKR1B1MEN1KMT2A
SCHEMBL3125961 0.80 GABRA1 (0.52) GABRA1GABRB2AKR1B1AURKADAPK3

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 32 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106954627-A A kind of method for preparing avermectin nanometer silica controlled release agent 西南大学 2017-07-18 CN claimed
CN-106614618-A A sterilization composition comprising 1-(2-hydroxyphenyl)-1-butanone and tebuconazole 江苏腾龙生物药业有限公司 2017-05-10 CN claimed
CN-101186577-A Liquid crystal monomer with reaction character and preparation method thereof NORTHWEST IND UNIVERSITY (CN) 2008-05-28 CN claimed
US-4028118-A AN ELECTRON-DONATING CHROMATIC COMPOUND, A PHENOLIC COMPOUND, A HIGHER ALIPHATIC ALCOHOL AND ESTER PILOT INK CO., LTD. (JA) 1977-06-07 US claimed
CN-106614618-A A sterilization composition comprising 1-(2-hydroxyphenyl)-1-butanone and tebuconazole 江苏腾龙生物药业有限公司 2017-05-10 CN disclosed
CN-106538582-A A kind of bactericidal composition of the ketone of bacterium containing phenol and Prochloraz 江苏腾龙生物药业有限公司 2017-03-29 CN disclosed
EP-1871844-B1 BUBBLE COMPOSITION WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2014-08-27 EP disclosed
CN-101427682-B Disinfection composition of mycophenolic ketone and dimethomorph JIANGSU TENGLONG BIOLOG PHARMACEUTICAL CO LTD 2012-09-26 CN disclosed
CN-101186577-A Liquid crystal monomer with reaction character and preparation method thereof NORTHWEST IND UNIVERSITY (CN) 2008-05-28 CN disclosed
EP-1871844-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C Technologies LLC (US) 2008-01-02 EP disclosed
US-20060236470-A1 Novelty compositions with color changing indicator CRAYOLA LLC 2006-10-26 US disclosed
WO-2006105191-A2 NOVELTY COMPOSITIONS WITH COLOR CHANGING INDICATOR C2C TECHNOLOGIES LLC (US) 2006-10-05 WO disclosed
EP-0013257-A2 Process for increase of light-fastness, fluorescence polarisation and fluorescence quantum efficiency of cyanine dyestuffs, stabilized cyanine dyestuff preparation, process for its preparation and its use CIBA-GEIGY AG (CH) 1980-07-09 EP disclosed
US-4202904-A AGRICULTURAL OR INDUSTRIAL FUNGICIDES AND BACTERICIDES UNIROYAL, INC. (US) 1980-05-13 US disclosed
US-4130664-A (Bis(diphenylaminomethane) antimicrobial agents UNIROYAL, INC. (US) 1978-12-19 US disclosed
US-4097580-A FUNGICIDES, BACTERICIDES, VIRICIDES UNIROYAL, INC. (US) 1978-06-27 US disclosed
US-4044139-A FUNGICIDES, BACTERICIDES UNIROYAL, INC. (US) 1977-08-23 US disclosed
US-4028118-A AN ELECTRON-DONATING CHROMATIC COMPOUND, A PHENOLIC COMPOUND, A HIGHER ALIPHATIC ALCOHOL AND ESTER PILOT INK CO., LTD. (JA) 1977-06-07 US disclosed
US-4004018-A FUNGICIDES, BACTERICIDES, VIRICIDES UNIROYAL INC. (US) 1977-01-18 US disclosed
US-3954868-A Bis(diphenylaminomethane) antimicrobial agents UNIROYAL, INC. (US) 1976-05-04 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-20060236470-A1 Novelty compositions with color changing indicator MITF, CRABP2, SHH GABRA1 2502/4885GABRB2 2065/4885AKR1B1 4613/4885

“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.