SCHEMBL1898200

SCHEMBL1898200

O=C(O)c1cc(-c2cccs2)nc2ccc(Cl)cc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.73
MEN1 O00255 5/20 0.73
RXFP1 Q9HBX9 3/20 0.73
PPARG P37231 2/20 0.73
PRNP P04156 1/20 0.73
NCOR2 Q9Y618 1/20 0.73
ALDH1A1 P00352 5/20 0.63
KDM4E B2RXH2 5/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
GAA P10253 3/20 0.63
HPGD P15428 2/20 0.63
CASP7 P55210 2/20 0.63
HSD17B10 Q99714 2/20 0.63
GLA P06280 2/20 0.63
TP53 P04637 1/20 0.63
CASP1 P29466 1/20 0.63
PTGES O14684 1/20 0.63
ALOX5 P09917 1/20 0.63
CYP2C9 P11712 1/20 0.63
HIF1A Q16665 1/20 0.63

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
SCHEMBL1896825 0.84 MEN1 (0.73) KMT2AMEN1RXFP1PPARGPRNP
SCHEMBL30064775 0.83 KDM4E (0.74) KMT2AMEN1RXFP1PPARGPRNP
SCHEMBL4461418 0.83 KDM4E (0.74) KMT2AMEN1RXFP1PPARGPRNP
SCHEMBL1898306 0.79 HSD17B10 (0.86) KMT2AALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL8175045 0.79 MEN1 (0.65) KMT2AMEN1RXFP1PPARGPRNP
SCHEMBL22471896 0.78 RXFP1 (0.67) KMT2AMEN1RXFP1PPARGPRNP
SCHEMBL14286200 0.77 HSD17B10 (1.00) KMT2AALDH1A1KDM4EHPGDCASP7
SCHEMBL5529524 0.77 HSD17B10 (0.94) KMT2AALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL9671860 0.74 ALDH1A1 (0.50) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL19475274 0.74 ALDH1A1 (0.71) KMT2AMEN1RXFP1PPARGPRNP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2325181-B1 STAT3 INHIBITOR CONTAINING QUINOLINECARBOXAMIDE DERIVATIVE AS ACTIVE INGREDIENT GENERAL INCORPORATED ASS PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2017-03-29 EP disclosed
US-8466290-B2 STAT3 inhibitor containing quinolinecarboxamide derivative as active ingredient PHARMA IP GENERAL INCORPORATED ASSOCIATION (JP) 2013-06-18 US disclosed
US-20110172429-A1 STAT3 INHIBITOR CONTAINING QUINOLINECARBOXAMIDE DERIVATIVE AS ACTIVE INGREDIENT PHARMA IP GENERAL INCORPORATED ASSOCIATION (JP) 2011-07-14 US disclosed
CN-102099352-A STAT3 inhibitor containing quinolinecarboxamide derivative as active ingredient PHARMA IP GENERAL INC ASS 2011-06-15 CN disclosed
EP-2325181-A1 STAT3 INHIBITOR CONTAINING QUINOLINECARBOXAMIDE DERIVATIVE AS ACTIVE INGREDIENT Pharma Ip General Incorporated Association (JP) 2011-05-25 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-20110172429-A1 STAT3 INHIBITOR CONTAINING QUINOLINECARBOXAMIDE DERIVATIVE AS ACTIVE INGREDIENT STAT3, STAT4, STAT5B KMT2A 255/4885MEN1 4247/4885RXFP1 97/4885

“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.