SCHEMBL4088341

SCHEMBL4088341

CC/C=C/c1ccc(OC)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 7/20 0.59
CYP1B1 Q16678 6/20 0.59
CYP1A2 P05177 3/20 0.59
TUBB4A P04350 1/20 0.59
TUBB P07437 1/20 0.59
TUBA3C P0DPH7 1/20 0.59
TUBA1B P68363 1/20 0.59
TUBA4A P68366 1/20 0.59
TUBB4B P68371 1/20 0.59
TUBB3 Q13509 1/20 0.59
TUBB2A Q13885 1/20 0.59
TUBB8 Q3ZCM7 1/20 0.59
TUBA3E Q6PEY2 1/20 0.59
TUBA1A Q71U36 1/20 0.59
TUBA1C Q9BQE3 1/20 0.59
TUBB6 Q9BUF5 1/20 0.59
TUBB2B Q9BVA1 1/20 0.59
TUBB1 Q9H4B7 1/20 0.59
NQO2 P16083 4/20 0.58
NFE2L2 Q16236 2/20 0.58

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
SCHEMBL4088345 1.00 CYP1A1 (0.59) CYP1A1CYP1B1CYP1A2TUBB4ATUBB
SCHEMBL25990002 0.85 TUBB1 (0.51) CYP1A1CYP1B1CYP1A2TUBB4ATUBB
SCHEMBL13349799 0.84 JUN (0.69) NFE2L2PTGS1ALDH1A1HPGDSMN1; SMN2
SCHEMBL25990220 0.84 APP (0.65) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL30293787 0.84 TYR (0.67) CYP1A2NFE2L2PTGS1PTGS2TTR
SCHEMBL11910660 0.84 TYR (0.67) CYP1A2NFE2L2PTGS1PTGS2TTR
SCHEMBL4257522 0.84 TYR (0.67) CYP1A2NFE2L2PTGS1PTGS2TTR
SCHEMBL20087219 0.84 TYR (0.67) CYP1A2NFE2L2PTGS1PTGS2TTR
SCHEMBL9431599 0.83 CYP1A1 (0.80) CYP1A1CYP1B1CYP1A2TUBB4ATUBB
SCHEMBL9586847 0.83 CYP1A1 (0.80) CYP1A1CYP1B1CYP1A2TUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090202666-A1 COSMETIC USE OF A CASSUMUNARIN, AN ARYLBUTENOID, AND/OR A BOTANICAL EXTRACT CONTAINING THEM CHANEL PARFUMS BEAUTE (FR) 2009-08-13 US claimed
EP-1870136-A1 Cosmetic use of a cussumunarine, an arylbutenoid and/or a plant extract containing the same Chanel Parfums Beauté (FR) 2007-12-26 EP claimed
WO-2007144270-A1 COSMETIC USE OF A CASSUMUNARIN, AN ARYLBUTENOID, AND/OR A BOTANICAL EXTRACT CONTAINING THEM CHANEL PARFUMS BEAUTE (FR) 2007-12-21 WO claimed
US-20230130823-A1 PROCESS FOR THE PRODUCTION OF ANTITUMOUR PHARMACEUTICAL COMPOSITIONS USING PUSH-PULL BUTADIENES, COMPOUNDS AND USES THEREOF ANHANGUERA EDUCACIONAL PARTICIPAÇÕES S/A (BR) 2023-04-27 US disclosed
US-20220409638-A1 ANTI-INFLAMMATORY COMPOUNDS AND USES THEREOF MEDICON PHARMACEUTICALS INC (US) 2022-12-29 US disclosed
US-20190307780-A1 Anti-Inflammatory Compounds and Uses Thereof MEDICON PHARMACEUTICALS, INC. (US) 2019-10-10 US disclosed
US-20090202666-A1 COSMETIC USE OF A CASSUMUNARIN, AN ARYLBUTENOID, AND/OR A BOTANICAL EXTRACT CONTAINING THEM CHANEL PARFUMS BEAUTE (FR) 2009-08-13 US disclosed
EP-1870136-A1 Cosmetic use of a cussumunarine, an arylbutenoid and/or a plant extract containing the same Chanel Parfums Beauté (FR) 2007-12-26 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 (4 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-20190307780-A1 Anti-Inflammatory Compounds and Uses Thereof TNF, NFKBIA, IL6 CYP1A1 1048/4885CYP1B1 1151/4885CYP1A2 647/4885
US-20230130823-A1 PROCESS FOR THE PRODUCTION OF ANTITUMOUR PHARMACEUTICAL COMPOSITIONS USING PUSH-PULL BUTADIENES, COMPOUNDS AND USES THEREOF BAD, BAX, PDCD4 CYP1A1 3806/4885CYP1B1 2250/4885CYP1A2 3500/4885
US-20090202666-A1 COSMETIC USE OF A CASSUMUNARIN, AN ARYLBUTENOID, AND/OR A BOTANICAL EXTRACT CONTAINING THEM ARNT, AHR, CUTA CYP1A1 109/4885CYP1B1 66/4885CYP1A2 204/4885
US-20220409638-A1 ANTI-INFLAMMATORY COMPOUNDS AND USES THEREOF TNF, NFKBIA, IL6 CYP1A1 1048/4885CYP1B1 1151/4885CYP1A2 647/4885

“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.