SCHEMBL1460165

SCHEMBL1460165

[c]1c(C=Cc2ccccc2)cc(C=Cc2ccccc2)cc1C=Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.47
ALOX5 P09917 1/20 0.47
PTGS1 P23219 1/20 0.47
PTGS2 P35354 1/20 0.47
MAOB P27338 3/20 0.46
NFE2L2 Q16236 3/20 0.45
CYP19A1 P11511 2/20 0.45
MAOA P21397 2/20 0.45
RELA Q04206 1/20 0.45
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44
TUBA3E Q6PEY2 1/20 0.44
TUBA1A Q71U36 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
SCHEMBL1460164 1.00 TTR (0.47) TTRALOX5PTGS1PTGS2MAOB
SCHEMBL3848997 0.83 NFE2L2 (0.52) ALOX5MAOBNFE2L2CYP19A1MAOA
SCHEMBL3848992 0.83 NFE2L2 (0.52) ALOX5MAOBNFE2L2CYP19A1MAOA
SCHEMBL3257028 0.79 MAOB (0.61) TTRALOX5PTGS1PTGS2MAOB
SCHEMBL3257033 0.79 MAOB (0.61) TTRALOX5PTGS1PTGS2MAOB
SCHEMBL3841784 0.76 NFE2L2 (0.45) TTRALOX5PTGS1PTGS2MAOB
SCHEMBL3841786 0.76 NFE2L2 (0.45) TTRALOX5PTGS1PTGS2MAOB
(Z)-1,2-Diphenylethene SCHEMBL9134296 0.76 MAOB (0.73) ALOX5MAOBNFE2L2CYP19A1MAOA
(Z)-1,2-Diphenylethene SCHEMBL22712863 0.76 MAOB (0.73) ALOX5MAOBNFE2L2CYP19A1MAOA
(Z)-1,2-Diphenylethene SCHEMBL21847984 0.76 MAOB (0.73) ALOX5MAOBNFE2L2CYP19A1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120264611-A1 Pesticide Preparations Containing Derivatives Of Pyrrolidone-4-Carboxylic Acid CLARIANT FINANCE (BVI) LIMITED (VG) 2012-10-18 US disclosed
EP-2480071-A1 PESTICIDE PREPARATIONS CONTAINING DERIVATIVES OF PYRROLIDONE-4-CARBOXYLIC ACID Clariant Finance (BVI) Limited (VG) 2012-08-01 EP disclosed
WO-2011035873-A1 PESTICIDE PREPARATIONS CONTAINING DERIVATIVES OF PYRROLIDONE-4-CARBOXYLIC ACID CLARIANT INTERNATIONAL LTD (CH) 2011-03-31 WO disclosed
US-20090318610-A1 ORGANIC INSULATING MATERIALS, VARNISHES FOR ORGANIC INSULATING FILM EMPLOYING THEM, ORGANIC INSULATING FILMS AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO., LTD (JP) 2009-12-24 US disclosed
EP-2117009-A1 ORGANIC INSULATING MATERIAL, VARNISH FOR ORGANIC INSULATING FILM USING THE SAME, ORGANIC INSULATING FILM AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Co., Ltd. (JP) 2009-11-11 EP disclosed
WO-2005054370-A2 ANTIFOAMING AGENT CLARIANT PRODUKTE (DEUTSCHLAND) GMBH (DE) 2005-06-16 WO disclosed
US-5958835-A Surfactant compositions NOVARTIS CORPORATION (FORMERLY CIBA-GEIGY CORPORATION) (US) 1999-09-28 US disclosed
US-5731266-A Herbicidal compositions comprising diamino-1,3,5-triazine and chloroacetanilide herbicides and a surfactant system CIBA-GEIGY CORPORATION (US) 1998-03-24 US disclosed
EP-0190995-B1 FLOWABLE HERBICIDAL AGENT CIBA-GEIGY AG (CH) 1993-07-28 EP disclosed
EP-0163598-B1 HERBICIDAL COMPOSITIONS CIBA-GEIGY AG (CH) 1989-10-04 EP disclosed
EP-0190995-A2 Flowable herbicidal agent CIBA-GEIGY AG (CH) 1986-08-13 EP disclosed
EP-0163598-A1 Herbicidal compositions CIBA-GEIGY AG (CH) 1985-12-04 EP disclosed
EP-0088049-B1 HERBICIDAL MIXTURES CIBA-GEIGY AG (CH) 1985-10-23 EP disclosed
US-4461641-A CHLOROTRIAZINES, CHLOROACETANILIDES, SURFACTANTS AND WATER CIBA-GEIGY CORPORATION (US) 1984-07-24 US disclosed
EP-0088049-A1 Herbicidal mixtures CIBA-GEIGY AG (CH) 1983-09-07 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-20120264611-A1 Pesticide Preparations Containing Derivatives Of Pyrrolidone-4-Carboxylic Acid DDT, HPD, AGPS TTR 801/4885ALOX5 60/4885PTGS1 3351/4885

“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.