SCHEMBL844487

SCHEMBL844487

Clc1[nH]nc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 1.00
CYP1A2 P05177 2/20 0.56
CYP2C19 P33261 1/20 0.56
PDPK1 O15530 2/20 0.48
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
PIK3CA P42336 4/20 0.42
PDK1 Q15118 4/20 0.42
MTOR P42345 3/20 0.42
PIK3CD O00329 1/20 0.42
PIK3CG P48736 1/20 0.42
TSHR P16473 1/20 0.40
GPR3 P46089 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL17692468 0.75 CYP1A2 (0.60) NOS1CYP1A2CYP2C19PDPK1MAOA
SCHEMBL30295893 0.74 NOS1 (0.59) NOS1CYP1A2CYP2C19PDPK1MAOA
SCHEMBL29470689 0.71 CYP1A2 (0.56) NOS1CYP1A2CYP2C19PDPK1MAOA
SCHEMBL21802595 0.71 CYP1A2 (1.00) NOS1CYP1A2CYP2C19PDPK1MAOA
SCHEMBL1100756 0.71 CYP1A2 (0.56) NOS1CYP1A2CYP2C19PDPK1MAOA
SCHEMBL16178927 0.71 CYP1A2 (0.56) NOS1CYP1A2CYP2C19PDPK1MAOA
SCHEMBL6845122 0.71 CYP1A2 (0.56) NOS1CYP1A2CYP2C19PIK3CAPDK1
Hydrochloric Acid SCHEMBL30262984 0.70 CYP1A2 (0.54) NOS1CYP1A2CYP2C19PDPK1PIK3CA
SCHEMBL12286155 0.68 CYP1A2 (0.52) NOS1CYP1A2CYP2C19PIK3CAPDK1
SCHEMBL20676148 0.67 NOS1 (0.50) NOS1CYP1A2CYP2C19PIK3CAPDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1255797-B2 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES OMG ELECTRONIC CHEMICALS INC (US) 2016-10-12 EP claimed
EP-1255797-B1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES OMG ELECTRONIC CHEMICALS INC (US) 2012-06-13 EP claimed
JP-4754752-B2 2011-08-24 JP claimed
EP-1255797-A4 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC (US) 2009-01-14 EP claimed
JP-2003519286-A 2003-06-17 JP claimed
EP-1255797-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2002-11-13 EP claimed
WO-2001049805-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2001-07-12 WO claimed
EP-2432776-B1 METHYL SULFANYL PYRIMIDINES USEFUL AS ANTIINFLAMMATORIES, ANALGESICS, AND ANTIEPILEPTICS UNIV LAVAL (CA) 2019-09-11 EP disclosed
EP-2432776-B1 METHYL SULFANYL PYRIMIDINES USEFUL AS ANTIINFLAMMATORIES, ANALGESICS, AND ANTIEPILEPTICS UNIV LAVAL (CA) 2019-09-11 EP disclosed
EP-1255797-B2 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES OMG ELECTRONIC CHEMICALS INC (US) 2016-10-12 EP disclosed
US-9315521-B2 Pyrimidines as novel therapeutic agents UNIVERSITé LAVAL (CA) 2016-04-19 US disclosed
US-9315521-B2 Pyrimidines as novel therapeutic agents UNIVERSITé LAVAL (CA) 2016-04-19 US disclosed
US-20150225423-A1 PYRIMIDINES AS NOVEL THERAPEUTIC AGENTS UNIVERSITé LAVAL (CA) 2015-08-13 US disclosed
US-6716281-B2 ADHESION PROMOTER COMPREISING OXIDIZER, PH ADJUSTER, TOPOGRAPHY MODIFIER; AND COATING STABILIZER COMPRISING 2-MERCAPTOTHIAZOLINE OR 2-MERCAPTOIMIDAZOLINE DERIVATIVE ELECTROCHEMICALS, INC. 2004-04-06 US disclosed
US-20040048486-A1 Method for roughening copper surfaces for bonding to substrates BERNARDS ROGER (US) 2004-03-11 US disclosed
US-20030213553-A1 Composition and method for preparing chemically-resistant roughened copper surfaces for bonding to substrates MACDERMID, INCORPORATED 2003-11-20 US disclosed
CN-1451031-A Method for roughening copper surfaces for bonding to substrates ELECTROCHEMICALS INC (US) 2003-10-22 CN disclosed
EP-1255797-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2002-11-13 EP disclosed
US-20020084441-A1 Method for roughening copper surfaces for bonding to substrates MACDERMID, INCORPORATED 2002-07-04 US disclosed
WO-2001049805-A1 METHOD FOR ROUGHENING COPPER SURFACES FOR BONDING TO SUBSTRATES ELECTROCHEMICALS INC. (US) 2001-07-12 WO 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-20150225423-A1 PYRIMIDINES AS NOVEL THERAPEUTIC AGENTS TYMS, P2RX2, TYMP NOS1 3128/4885CYP1A2 55/4885CYP2C19 32/4885

“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.