SCHEMBL4815367

SCHEMBL4815367

C=CCc1cnc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.50
PDGFRA P16234 2/20 0.50
CYP1A2 P05177 2/20 0.47
RAB9A P51151 1/20 0.44
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
MGAM O43451 1/20 0.42
ALDH1A1 P00352 2/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41

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
SCHEMBL4819797 0.86 PDGFRB (0.47) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL273345 0.84 PDGFRB (0.51) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL4819350 0.83 PDGFRB (0.47) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL5508798 0.83 PDGFRB (0.47) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL3396692 0.83 CYP1A2 (0.55) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL28879834 0.82 PDGFRB (0.50) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL4815350 0.82 PDGFRB (0.50) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL16612703 0.81 PDGFRB (0.46) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL4817698 0.80 CYP1A2 (0.48) PDGFRBPDGFRACYP1A2RAB9AKDM1A
SCHEMBL3820110 0.79 CYP1A2 (0.52) PDGFRBPDGFRACYP1A2RAB9AKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0247277-B1 PROCESS FOR THE PREPARATION OF 5-ALKYLQUINOLINIC ACIDS AND MEANS FOR CARRYING OUT THIS PROCESS RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1991-09-11 EP claimed
CN-103539734-A Preparation method of 3-allyl quinoline UNIV SHANGHAI JIAOTONG 2014-01-29 CN disclosed
CN-103539734-A Preparation method of 3-allyl quinoline UNIV SHANGHAI JIAOTONG 2014-01-29 CN disclosed
CN-102766089-A 3-(3-quinolyl)-2-propenyl-1-halide and its preparation method SHANGHAI INST PHARM INDUSTRY 2012-11-07 CN disclosed
US-20100247938-A1 MATERIAL FOR THREE-DIMENSIONAL MODELING, PROCESS FOR PRODUCING THREE-DIMENSIONAL MODEL, AND THREE-DIMENSIONAL MODEL FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed
US-20100247938-A1 MATERIAL FOR THREE-DIMENSIONAL MODELING, PROCESS FOR PRODUCING THREE-DIMENSIONAL MODEL, AND THREE-DIMENSIONAL MODEL FUJIFILM CORPORATION (JP) 2010-09-30 US disclosed
US-7365174-B2 Azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2008-04-29 US disclosed
US-RE39836-E1 Macrolide antinfective agents KOSAN BIOSCIENCES, INC. (US) 2007-09-11 US disclosed
US-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same MEIJI SEIKA KAISHA, LTD. (JP) 2007-02-22 US disclosed
EP-1661904-A1 NOVEL AZALIDE AND AZALACTAM DERIVATIVES AND PROCESS FOR THE PRODUCTION OF THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2006-05-31 EP disclosed
US-6593302-B2 Antibiotics KOSAN BIOSCIENCES, INC. 2003-07-15 US disclosed
US-20020119938-A1 Macrolide antiinfective agents CHU DANIEL (US) 2002-08-29 US disclosed
US-6395710-B1 CONTROLLING INFECTIONS KOSAN BIOSCIENCES, INC. 2002-05-28 US disclosed
EP-1171446-A2 MACROLIDE ANTIINFECTIVE AGENTS Kosan Biosciences, Inc. (US) 2002-01-16 EP disclosed
EP-0847389-A4 PROCESS FOR PREPARING QUINOLINE BASES REILLY IND INC (US) 2001-04-11 EP disclosed
WO-2000063224-A2 MACROLIDE ANTIINFECTIVE AGENTS KOSAN BIOSCIENCES, INC. (US) 2000-10-26 WO disclosed
EP-0847389-A1 PROCESS FOR PREPARING QUINOLINE BASES REILLY INDUSTRIES, INC. (US) 1998-06-17 EP disclosed
US-5700942-A Process for preparing quinoline bases REILLY INDUSTRIES, INC. (US) 1997-12-23 US disclosed
WO-1997003051-A1 PROCESS FOR PREPARING QUINOLINE BASES REILLY INDUSTRIES, INC. (US) 1997-01-30 WO disclosed
EP-0247277-A2 Process for the preparation of 5-alkylquinolinic acids and means for carrying out this process RÜTGERSWERKE AKTIENGESELLSCHAFT (DE) 1987-12-02 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 (2 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-20020119938-A1 Macrolide antiinfective agents MLNR, DOHH, NOP2 PDGFRB 2778/4885PDGFRA 3142/4885CYP1A2 2938/4885
US-20070042974-A1 Nozel azalide and azalactam derivatives and method for producing the same BCL6, NR4A1, NR4A2 PDGFRB 2207/4885PDGFRA 2360/4885CYP1A2 583/4885

“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.