SCHEMBL1034096

SCHEMBL1034096

Cc1noc(NC(=O)c2cccc3ccc(-c4cccc(C(F)(F)F)c4)nc23)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.48
▸ FLT1 P17948 1/20 0.42
▸ KDR P35968 1/20 0.42
▸ CNR2 P34972 2/20 0.41
▸ FGFR4 P22455 2/20 0.41
▸ CNR1 P21554 1/20 0.41
▸ MAPKAPK2 P49137 1/20 0.41
▸ BRD4 O60885 1/20 0.40
▸ KDM1A O60341 1/20 0.40
▸ RXFP1 Q9HBX9 2/20 0.40
▸ PIK3CD O00329 1/20 0.39
▸ PIK3CA P42336 1/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ KMO O15229 1/20 0.39
▸ PARP1 P09874 1/20 0.39
▸ CRHR1 P34998 1/20 0.39
▸ P2RY1 P47900 1/20 0.38
▸ AR P10275 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38

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
SCHEMBL1034573 0.87 BRD4 (0.43) LMNACNR2FGFR4CNR1MAPKAPK2
SCHEMBL1035391 0.85 MAPK1 (0.53) LMNAFGFR4MAPKAPK2RXFP1HTT
SCHEMBL1034416 0.80 KMT2A (0.48) CNR2FGFR4CNR1MAPKAPK2KDM1A
SCHEMBL1030361 0.80 AR (0.42) CNR2FGFR4CNR1MAPKAPK2KDM1A
SCHEMBL1034065 0.80 RXFP1 (0.53) LMNARXFP1PARP1HTT
SCHEMBL1034305 0.79 KMO (0.49) LMNACNR2FGFR4CNR1MAPKAPK2
SCHEMBL1035365 0.79 PHGDH (0.46) CNR2FGFR4CNR1MAPKAPK2KMO
SCHEMBL1034072 0.78 JAK2 (0.51) LMNAFLT1KDRCNR2CNR1
SCHEMBL17772340 0.78 DHODH (0.42) CNR2FGFR4CNR1MAPKAPK2RXFP1
SCHEMBL1073743 0.78 ADORA2A (0.48) CNR2FGFR4CNR1MAPKAPK2KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2273992-B1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2016-05-25 — — EP disclosed
EP-2273992-B1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC (US) 2016-05-25 — — EP disclosed
US-20110046110-A1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2011-02-24 — — US disclosed
US-20110046110-A1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2011-02-24 — — US disclosed
US-20110046110-A1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS GLAXOSMITHKLINE LLC 2011-02-24 — — US disclosed
EP-2273992-A1 QUENOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS Sirtris Pharmaceuticals, Inc. (US) 2011-01-19 — — EP disclosed
WO-2009134973-A1 QUENOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2009-11-05 — — WO disclosed
WO-2009134973-A1 QUENOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS SIRTRIS PHARMACEUTICALS, INC. (US) 2009-11-05 — — WO 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-20110046110-A1 QUINOLINES AND RELATED ANALOGS AS SIRTUIN MODULATORS SIRT3, SIRT1, SIRT2 LMNA 3200/4885FLT1 1112/4885KDR 1845/4885

“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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