SCHEMBL998077

SCHEMBL998077

N#Cc1ccc2cc(C(=O)O)ccc2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.53
SRPK1 Q96SB4 2/20 0.46
CHEK1 O14757 1/20 0.46
PDPK1 O15530 1/20 0.46
DYRK3 O43781 1/20 0.46
MAP4K4 O95819 1/20 0.46
RET P07949 1/20 0.46
PIM1 P11309 1/20 0.46
KDR P35968 1/20 0.46
CSNK1D P48730 1/20 0.46
CLK2 P49760 1/20 0.46
GSK3A P49840 1/20 0.46
GSK3B P49841 1/20 0.46
IRAK1 P51617 1/20 0.46
NEK4 P51957 1/20 0.46
CSNK2A1 P68400 1/20 0.46
CSNK1G2 P78368 1/20 0.46
CAMK2D Q13557 1/20 0.46
DYRK1A Q13627 1/20 0.46
NTRK3 Q16288 1/20 0.46

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
Hydrochloric Acid SCHEMBL999577 0.98 NQO1 (0.51) NQO1SRPK1CHEK1PDPK1DYRK3
SCHEMBL999576 0.85 NQO1 (0.51) NQO1SRPK1CHEK1PDPK1DYRK3
SCHEMBL7342519 0.81 NQO1 (0.59) NQO1KDM4ETDP1NPC1RAB9A
SCHEMBL17442536 0.78 KLKB1 (0.44) NQO1
SCHEMBL25401591 0.76 NQO1 (0.49) NQO1KDM4ETDP1SLC22A12ALDH1A1
SCHEMBL16881094 0.76 KLKB1 (0.41) NQO1KDM4ESLC22A12ALDH1A1MEN1
SCHEMBL138949 0.75 NQO1 (0.59) NQO1KDM4EALDH1A1GAAESR2
SCHEMBL3561878 0.75 PLAU (0.54) SRPK1CHEK1PDPK1DYRK3MAP4K4
SCHEMBL1309231 0.75 TDP1 (0.50) SRPK1KDM4ETDP1NPC1RAB9A
SCHEMBL69982 0.75 MGAM (0.58) SRPK1KDM4ETDP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2456759-B1 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2017-04-19 EP disclosed
US-8822691-B2 Pesticidal carboxamides BAYER CROPSCIENCE AG (DE) 2014-09-02 US disclosed
US-20120277185-A1 Pesticidal Carboxamides BAYER CROPSCIENDE AG (DE) 2012-11-01 US disclosed
CN-102548967-A Pesticidal carboxamides BAYER CROPSCIENCE AG 2012-07-04 CN disclosed
EP-2456759-A2 PESTICIDAL CARBOXAMIDES Bayer CropScience AG (DE) 2012-05-30 EP disclosed
WO-2011009540-A2 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2011-01-27 WO disclosed
US-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2006-11-23 US 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-20120277185-A1 Pesticidal Carboxamides DDT, ACHE, AADAC NQO1 1738/4885SRPK1 4303/4885CHEK1 4240/4885
US-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same TNNI3K, CSNK1A1L, CDKL1 NQO1 1057/4885SRPK1 147/4885CHEK1 98/4885

“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.