SCHEMBL467396

SCHEMBL467396

O=C(Nc1ccc(Cl)c(Cl)c1)c1cc(Cl)ccc1O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX1 P51575 9/20 0.77
TMPRSS4 Q9NRS4 8/20 0.71
P2RX4 Q99571 4/20 0.70
P2RX7 Q99572 4/20 0.70
PTGS1 P23219 1/20 0.68
TBXAS1 P24557 1/20 0.68
MAPK1 P28482 1/20 0.68
PTGS2 P35354 1/20 0.68
MAPK14 Q16539 1/20 0.68
KCNMA1 Q12791 2/20 0.64
HDAC3 O15379 1/20 0.61
EGFR P00533 1/20 0.61
HDAC4 P56524 1/20 0.61
HDAC1 Q13547 1/20 0.61
HDAC7 Q8WUI4 1/20 0.61
HDAC2 Q92769 1/20 0.61
HDAC10 Q969S8 1/20 0.61
HDAC11 Q96DB2 1/20 0.61
HDAC8 Q9BY41 1/20 0.61
HDAC6 Q9UBN7 1/20 0.61

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
SCHEMBL30771736 0.88 P2RX1 (0.74) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL18341118 0.88 P2RX1 (0.74) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL18290067 0.88 PNLIP (0.67) P2RX1TMPRSS4P2RX4P2RX7PTGS1
SCHEMBL29454776 0.87 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL2169619 0.87 P2RX1 (1.00) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL23675396 0.87 P2RX1 (0.70) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL30100500 0.87 P2RX1 (0.70) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL20413313 0.87 P2RX1 (0.70) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL14886091 0.86 P2RX1 (0.77) P2RX1TMPRSS4P2RX4P2RX7KCNMA1
SCHEMBL28916380 0.85 P2RX1 (0.68) P2RX1TMPRSS4P2RX4P2RX7KCNMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3263145-B1 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR LOCKING CATHETERS BECTON DICKINSON CO (US) 2021-01-20 EP claimed
US-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY 2020-02-06 US claimed
EP-3313388-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE Duke University (US) 2018-05-02 EP claimed
US-9872941-B2 Antimicrobial compositions and methods for locking catheters BECTON, DICKINSON AND COMPANY (US) 2018-01-23 US claimed
EP-3263145-A1 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR LOCKING CATHETERS Becton, Dickinson and Company (US) 2018-01-03 EP claimed
EP-1998825-B1 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR LOCKING CATHETERS BECTON DICKINSON CO (US) 2017-10-18 EP claimed
US-20170216493-A1 Antimicrobial Compositions and Methods for Locking Catheters BECTON, DICKINSON AND COMPANY 2017-08-03 US claimed
US-9649411-B2 Antimicrobial compositions and methods for locking catheters BECTON, DICKINSON AND COMPANY (US) 2017-05-16 US claimed
WO-2016210289-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE DUKE UNIVERSITY (US) 2016-12-29 WO claimed
US-20160213818-A1 Antimicrobial Compositions and Methods for Locking Catheters BECTON, DICKINSON AND COMPANY 2016-07-28 US claimed
WO-2007100776-A2 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR LOCKING CATHETERS BECTON, DICKINSON AND COMPANY (US) 2007-09-07 WO claimed
US-20070202177-A1 Antimicrobial Compositions and Methods for Locking Catheters BECTON, DICKINSON AND COMPANY (US) 2007-08-30 US claimed
EP-1071324-B1 BLOOMING TYPE GERMICIDAL HARD-SURFACE CLEANERS RECKITT BENCKISER INC (US) 2004-02-11 EP claimed
US-6395697-B1 IN SOLVENT AND WATER SOLUTION RECKITT BENCKISER INC. 2002-05-28 US claimed
EP-1073470-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING COMPOUNDS WITH ACTIVITY FOR THE ENHANCEMENT OF ABSORPTION OF ACTIVE INGREDIENTS INPHARMA S.A. (CH) 2001-02-07 EP claimed
EP-1071324-A1 BLOOMING TYPE GERMICIDAL HARD-SURFACE CLEANERS Reckitt Benckiser Inc. (US) 2001-01-31 EP claimed
WO-2000048636-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING COMPOUNDS WITH ACTIVITY FOR THE ENHANCEMENT OF ABSORPTION OF ACTIVE INGREDIENTS INPHARMA S.A. (CH) 2000-08-24 WO claimed
US-6066606-A MIXTURE OF TERPENE, SURFACTANT AND WATER RECKITT & COLMAN INC. (US) 2000-05-23 US claimed
WO-1999052361-A1 BLOOMING TYPE GERMICIDAL HARD-SURFACE CLEANERS RECKITT BENCKISER INC. (US) 1999-10-21 WO claimed
US-4326977-A Liquid antiseptic cleaners with improved foaming properties BASF WYANDOTTE CORPORATION (US) 1982-04-27 US claimed

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-20200038350-A1 CHEMICAL MODULATORS OF SIGNALING PATHWAYS AND THERAPEUTIC USE SFRP1, FZD7, WNT1 P2RX1 3423/4885TMPRSS4 2074/4885P2RX4 3784/4885

“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.