SCHEMBL1898703

SCHEMBL1898703

O=C(Nc1nnc(-c2ccncc2)s1)c1cc(-c2ccccc2)nc2ccc(Cl)cc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APOBEC3G Q9HC16 5/20 0.67
▸ CYP2C9 P11712 4/20 0.65
▸ APOBEC3A P31941 2/20 0.62
▸ APOBEC3B Q9UH17 1/20 0.62
▸ MAPT P10636 6/20 0.60
▸ GAA P10253 1/20 0.60
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ HTT P42858 1/20 0.55
▸ MAPK1 P28482 3/20 0.54
▸ ALDH1A1 P00352 2/20 0.54
▸ RECQL P46063 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ CYP3A4 P08684 1/20 0.53
▸ CA12 O43570 1/20 0.53
▸ CA1 P00915 1/20 0.53
▸ CA2 P00918 1/20 0.53
▸ CA9 Q16790 1/20 0.53

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
SCHEMBL1901378 0.93 CYP2C9 (0.62) APOBEC3GCYP2C9APOBEC3AAPOBEC3BMAPT
SCHEMBL1898383 0.89 APOBEC3G (0.77) APOBEC3GCYP2C9APOBEC3AAPOBEC3BMAPT
SCHEMBL1901858 0.85 APOBEC3G (0.56) APOBEC3GCYP2C9APOBEC3AAPOBEC3BMAPT
SCHEMBL1898793 0.85 L3MBTL1 (0.59) CYP2C9MAPTGAAMEN1KMT2A
SCHEMBL1899898 0.83 APOBEC3G (0.56) APOBEC3GCYP2C9APOBEC3AAPOBEC3BMAPT
SCHEMBL1898854 0.83 MAPT (0.74) APOBEC3GCYP2C9APOBEC3AAPOBEC3BMAPT
SCHEMBL1901939 0.79 CYP2C9 (0.69) APOBEC3GCYP2C9APOBEC3AAPOBEC3BMAPT
SCHEMBL27848704 0.78 CYP2C9 (0.72) CYP2C9MAPTMEN1KMT2AMAPK1
SCHEMBL1899341 0.77 APOBEC3G (0.64) APOBEC3GCYP2C9APOBEC3AAPOBEC3BMAPT
SCHEMBL22542789 0.76 CYP2C9 (0.74) CYP2C9MAPTMEN1KMT2AMAPK1

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 4 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
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 APOBEC3G 4852/4885CYP2C9 2835/4885APOBEC3A 4808/4885

“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.

Send feedback