P-Xylene

P-Xylene

SCHEMBL6429103

Cc1ccc(C)cc1.Cc1ccc(C)cc1.Cc1ccc(C)cc1.Cc1ccc(C)cc1.Cc1ccc(C)cc1.Cc1ccc(C)cc1.Cc1ccc(C)cc1.Cc1ccc(C)cc1.Cc1ccc(CCCCCO)cc1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 1/20 0.57
▸ ALOX15 P16050 1/20 0.57
▸ CA2 P00918 2/20 0.53
▸ CYP4A11 Q02928 2/20 0.52
▸ CYP4F2 P78329 1/20 0.52
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.48
▸ HRH1 P35367 1/20 0.47
▸ ESR1 P03372 2/20 0.47
▸ ADRA2A P08913 2/20 0.47
▸ ADORA3 P0DMS8 2/20 0.47
▸ TACR2 P21452 2/20 0.47
▸ SLC6A2 P23975 2/20 0.47
▸ SLC6A4 P31645 2/20 0.47
▸ SLC6A3 Q01959 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ SHBG P04278 1/20 0.47

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
SCHEMBL6207049 1.00 IGF1R (0.57) IGF1RALOX15CA2CYP4A11CYP4F2
SCHEMBL11286656 1.00 IGF1R (0.57) IGF1RALOX15CA2CYP4A11CYP4F2
SCHEMBL93545 1.00 IGF1R (0.57) IGF1RALOX15CA2CYP4A11CYP4F2
SCHEMBL9422698 1.00 IGF1R (0.57) IGF1RALOX15CA2CYP4A11CYP4F2
SCHEMBL12827576 1.00 IGF1R (0.57) IGF1RALOX15CA2CYP4A11CYP4F2
Methyl Alcohol SCHEMBL9951500 0.98 IGF1R (0.55) IGF1RALOX15CA2CYP4A11CYP4F2
SCHEMBL285785 0.98 IGF1R (0.59) IGF1RALOX15CA2CYP4A11CYP4F2
SCHEMBL80441 0.91 IGF1R (0.55) IGF1RALOX15CA2CYP4A11CYP4F2
Toluene SCHEMBL7575476 0.90 IGF1R (0.52) IGF1RALOX15CA2CYP4A11CYP4F2
Propylene Glycol SCHEMBL9068204 0.89 IGF1R (0.47) IGF1RALOX15CA2CYP4A11CYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050256121-A1 e.g. 3-(4-fluorophenyl)-N-{5-[2-(methylamino)pyrimidin-4-yl]thien-2-yl}propanamide; PKB/Akt kinase inhibitor; anticarcinogenic agent; carcinoma, cancer metastases, squamous cell carcinoma, esophageal squamous cell carcinoma, oral carcinoma, cutaneous T cell lymphoma, Hodgkin's lymphoma CHIRON CORPORATION (US) 2005-11-17 — — US disclosed
EP-0803555-B1 Top coating compositions TOYOTA MOTOR CO LTD (JP) 2002-07-24 — — EP disclosed
EP-0803555-A2 Top coating compositions TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 1997-10-29 — — EP disclosed
EP-0305060-B1 Polymer non-aqueous dispersion, process for preparing the same and coating composition formulated therewith NIPPON OILS & FATS CO LTD (JP) 1994-07-27 — — EP disclosed
EP-0382454-B1 High solids coating composition, and coated articles and coating process using the same NIPPON OILS & FATS CO LTD (JP) 1994-06-08 — — EP disclosed
EP-0416329-B1 Resin composition for use as paint NIPPON OILS & FATS CO LTD (JP) 1994-06-01 — — EP disclosed
EP-0267731-B1 HIGH SOLIDS COATING COMPOSITIONS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1993-01-20 — — EP disclosed
US-5093390-A Automobile paints NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-03-03 — — US disclosed
US-5091492-A Copolymer of polcyclic compound contiaing (meth)acryloyloxy group and unsaturated monomer NIPPON OIL AND FATS CO., LTD. (JP) 1992-02-25 — — US disclosed
EP-0416329-A1 Resin composition for use as paint NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-03-13 — — EP disclosed
US-4963601-A Polymer non-aqueous dispersion, process for preparing the same and coating composition formulated therewith NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1990-10-16 — — US disclosed
EP-0382454-A1 High solids coating composition, and coated articles and coating process using the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1990-08-16 — — EP disclosed
EP-0185338-B1 PROCESS FOR COATING SUBSTRATES HAVING ELECTRICALLY CONDUCTIVE SURFACES Herberts Gesellschaft mit beschränkter Haftung (DE) 1989-05-24 — — EP disclosed
EP-0305060-A2 Polymer non-aqueous dispersion, process for preparing the same and coating composition formulated therewith NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-03-01 — — EP disclosed
EP-0267731-A2 High solids coating compositions NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-05-18 — — EP disclosed
EP-0185338-A1 Process for coating substrates having electrically conductive surfaces Herberts Gesellschaft mit beschränkter Haftung (DE) 1986-06-25 — — 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-20050256121-A1 e.g. 3-(4-fluorophenyl)-N-{5-[2-(methylamino)pyrimidin-4-yl]thien-2-yl}propanamide; PKB/Akt kinase inhibitor; anticarcinogenic agent; carcinoma, cancer metastases, squamous cell carcinoma, esophageal squamous cell carcinoma, oral carcinoma, cutaneous T cell lymphoma, Hodgkin's lymphoma MALT1, AKT1, PIK3CA IGF1R 1010/4885ALOX15 3443/4885CA2 1764/4885

“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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