SCHEMBL1899341

SCHEMBL1899341

CC(C)Oc1cccc(-c2cc(C(=O)Nc3nnc(-c4ccncc4)s3)c3ccccc3n2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APOBEC3G Q9HC16 4/20 0.64
▸ APOBEC3A P31941 2/20 0.64
▸ MAPT P10636 4/20 0.63
▸ KMT2A Q03164 7/20 0.63
▸ MEN1 O00255 6/20 0.63
▸ APOBEC3B Q9UH17 1/20 0.62
▸ GAA P10253 1/20 0.61
▸ ALDH1A1 P00352 4/20 0.59
▸ KDM4E B2RXH2 3/20 0.59
▸ HPGD P15428 2/20 0.59
▸ LMNA P02545 2/20 0.59
▸ ALOX12 P18054 1/20 0.59
▸ DUSP3 P51452 1/20 0.59
▸ PTPN5 P54829 1/20 0.59
▸ PTPN11 Q06124 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ RAB9A P51151 1/20 0.56
▸ CYP2C9 P11712 3/20 0.55
▸ CYP3A4 P08684 3/20 0.55
▸ MAPK1 P28482 1/20 0.55

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
SCHEMBL1898383 0.87 APOBEC3G (0.77) APOBEC3GAPOBEC3AMAPTKMT2AMEN1
SCHEMBL1898854 0.82 MAPT (0.74) APOBEC3GAPOBEC3AMAPTKMT2AMEN1
SCHEMBL1898606 0.79 APOBEC3G (0.63) APOBEC3GAPOBEC3AMAPTKMT2AMEN1
SCHEMBL17318569 0.78 NPC1 (0.65) APOBEC3GMAPTKMT2AMEN1GAA
SCHEMBL1901215 0.78 APOBEC3G (1.00) APOBEC3GAPOBEC3AMAPTKMT2AMEN1
SCHEMBL1901939 0.78 CYP2C9 (0.69) APOBEC3GAPOBEC3AMAPTKMT2AMEN1
SCHEMBL1898703 0.77 APOBEC3G (0.67) APOBEC3GAPOBEC3AMAPTKMT2AMEN1
SCHEMBL1899898 0.77 APOBEC3G (0.56) APOBEC3GAPOBEC3AMAPTKMT2AMEN1
SCHEMBL8614314 0.75 KMT2A (0.65) MAPTKMT2AMEN1GAAALDH1A1
SCHEMBL1901542 0.74 L3MBTL1 (0.73) APOBEC3GAPOBEC3AMAPTKMT2AMEN1

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 4852/4885APOBEC3A 4808/4885MAPT 4208/4885

“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.

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