SCHEMBL3481961

SCHEMBL3481961

O=C(c1cccnc1)c1cc(Cl)ccc1Cl

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
POLB P06746 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
TDP1 Q9NUW8 1/20 0.62
CCR9 P51686 2/20 0.60
ALDH1A1 P00352 3/20 0.53
LMNA P02545 2/20 0.53
PKM P14618 2/20 0.53
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 2/20 0.52
NFKB1 P19838 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
KCNMA1 Q12791 2/20 0.51
MAPT P10636 2/20 0.50
CSF1R P07333 1/20 0.50
HPGD P15428 1/20 0.50
CYP1A1 P04798 1/20 0.48

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
SCHEMBL14419269 0.86 KCNMA1 (0.60) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL28232 0.86 CCR9 (0.58) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL3201369 0.84 CCR9 (0.56) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL6770549 0.82 HPGD (0.59) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL7397552 0.82 CCR9 (0.54) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL14419272 0.81 MAPK1 (0.64) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL28254180 0.81 CSF1R (0.55) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL10084180 0.81 TDP1 (0.54) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL6769553 0.80 ALDH1A1 (0.56) RAB9AMEN1KMT2APOLBSMN1; SMN2
SCHEMBL3481832 0.80 JAK2 (0.59) RAB9AMEN1KMT2APOLBSMN1; SMN2

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
US-8729219-B2 Polyarylene block copolymer having sulfonic acid group and use thereof JSR CORPORATION (JP) 2014-05-20 US disclosed
US-8729219-B2 Polyarylene block copolymer having sulfonic acid group and use thereof JSR CORPORATION (JP) 2014-05-20 US disclosed
EP-2157644-B1 ELECTRODE ELECTROLYTE FOR POLYMER FUEL CELL AND USE THEREOF JSR CORP (JP) 2013-09-11 EP disclosed
US-20130085236-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF JSR CORPORATION (JP) 2013-04-04 US disclosed
US-20130085236-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF JSR CORPORATION (JP) 2013-04-04 US disclosed
US-8309678-B2 Aromatic compound and polyarylene copolymer having nitrogen-containing heterocycle including sulfonic acid group in side chain JSR CORPORATION (JP) 2012-11-13 US disclosed
US-8309678-B2 Aromatic compound and polyarylene copolymer having nitrogen-containing heterocycle including sulfonic acid group in side chain JSR CORPORATION (JP) 2012-11-13 US disclosed
US-8273499-B2 Membrane-electrode assembly for solid polymer electrolyte fuel cell HONDA MOTOR CO., LTD. (JP) 2012-09-25 US disclosed
US-8273499-B2 Membrane-electrode assembly for solid polymer electrolyte fuel cell HONDA MOTOR CO., LTD. (JP) 2012-09-25 US disclosed
US-8273499-B2 Membrane-electrode assembly for solid polymer electrolyte fuel cell HONDA MOTOR CO., LTD. (JP) 2012-09-25 US disclosed
US-20120052412-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF HONDA MOTOR CO., LTD. (JP) 2012-03-01 US disclosed
US-20120052412-A1 POLYARYLENE BLOCK COPOLYMER HAVING SULFONIC ACID GROUP AND USE THEREOF HONDA MOTOR CO., LTD. (JP) 2012-03-01 US disclosed
US-20100167161-A1 ELECTRODE ELECTROLYTE FOR POLYMER-TYPE FUEL CELL, AND USE THEREOF JSR CORPORATION (JP) 2010-07-01 US disclosed
US-20100167161-A1 ELECTRODE ELECTROLYTE FOR POLYMER-TYPE FUEL CELL, AND USE THEREOF JSR CORPORATION (JP) 2010-07-01 US disclosed
US-20100152308-A1 NOVEL AROMATIC COMPOUND AND POLYARYLENE COPOLYMER HAVING NITROGEN-CONTAINING HETEROCYCLE INCLUDING SULFONIC ACID GROUP IN SIDE CHAIN JSR CORPORATION (JP) 2010-06-17 US disclosed
US-20100152308-A1 NOVEL AROMATIC COMPOUND AND POLYARYLENE COPOLYMER HAVING NITROGEN-CONTAINING HETEROCYCLE INCLUDING SULFONIC ACID GROUP IN SIDE CHAIN JSR CORPORATION (JP) 2010-06-17 US disclosed
US-20100062311-A1 MEMBRANE-ELECTRODE ASSEMBLY FOR SOLID POLYMER ELECTROLYTE FUEL CELL HONDA MOTOR CO., LTD. (JP) 2010-03-11 US disclosed
US-20100062311-A1 MEMBRANE-ELECTRODE ASSEMBLY FOR SOLID POLYMER ELECTROLYTE FUEL CELL HONDA MOTOR CO., LTD. (JP) 2010-03-11 US disclosed
US-20100062311-A1 MEMBRANE-ELECTRODE ASSEMBLY FOR SOLID POLYMER ELECTROLYTE FUEL CELL HONDA MOTOR CO., LTD. (JP) 2010-03-11 US disclosed
EP-2157644-A1 ELECTRODE ELECTROLYTE FOR POLYMER FUEL CELL AND USE THEREOF JSR Corporation (JP) 2010-02-24 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-20100152308-A1 NOVEL AROMATIC COMPOUND AND POLYARYLENE COPOLYMER HAVING NITROGEN-CONTAINING HETEROCYCLE INCLUDING SULFONIC ACID GROUP IN SIDE CHAIN SCO2, H1-0, H1-10 RAB9A 3347/4885MEN1 3006/4885KMT2A 2365/4885

“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.