SCHEMBL6336695

SCHEMBL6336695

COc1cc2c(Cl)c(C(=O)O)cnc2cc1OCCCC1CCCNC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACP1 P24666 7/20 0.41
▸ EHMT2 Q96KQ7 2/20 0.41
▸ KIT P10721 1/20 0.41
▸ EGFR P00533 2/20 0.40
▸ IRAK4 Q9NWZ3 3/20 0.39
▸ ABL1 P00519 1/20 0.38
▸ SRC P12931 1/20 0.38
▸ ABL2 P42684 1/20 0.38
▸ CSF1R P07333 1/20 0.38
▸ PDGFRB P09619 1/20 0.38
▸ AXL P30530 1/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ MERTK Q12866 1/20 0.38
▸ ROCK2 O75116 1/20 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
SCHEMBL6343097 0.90 ACP1 (0.42) ACP1EHMT2KITIRAK4PDGFRB
SCHEMBL6337390 0.90 KDM4E (0.46) ACP1EHMT2KITIRAK4PDGFRB
SCHEMBL6336434 0.85 EHMT2 (0.44) ACP1EHMT2KITEGFRABL1
SCHEMBL6591706 0.85 EHMT2 (0.44) ACP1EHMT2KITABL1SRC
SCHEMBL6338533 0.83 SRC (0.51) EHMT2KITEGFRIRAK4ABL1
SCHEMBL6592750 0.82 DPP4 (0.42) ACP1EHMT2KITIRAK4PDGFRB
SCHEMBL6336693 0.79 EGFR (0.39) EHMT2EGFRIRAK4CSF1R
SCHEMBL6344436 0.78 SRC (0.47) EHMT2KITEGFRABL1SRC
SCHEMBL7165177 0.77 EGFR (0.58) EGFRCSF1R
SCHEMBL31554519 0.77 EGFR (0.58) EGFRCSF1R

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
US-6960580-B2 Nitrogenous heterocyclic substituted quinoline compounds MILLENNIUM PHARMACEUTICALS, INC. (US) 2005-11-01 — — US disclosed
EP-1490362-A2 (HOMO)PIPERAZINE SUBSTITUTED QUINOLINES FOR INHIBITING THE PHOSPHORYLATION OF KINASES Millennium Pharmaceuticals, Inc. (US) 2004-12-29 — — EP disclosed
US-20030004158-A1 Nitrogen containing heterocyclic quinoline compounds MILLENNIUM PHARMACEUTICALS, INC. 2003-01-02 — — US disclosed
WO-2002072578-A2 (HOMO) PIPERAZINE SUBSTITUTED QUINOLINES FOR INHIBITING THE PHOSPHORYLATION OF KINASES MILLENNIUM PHARMACEUTICALS (US) 2002-09-19 — — 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-20030004158-A1 Nitrogen containing heterocyclic quinoline compounds WNK2, PDGFA, PDGFRA ACP1 292/4885EHMT2 4072/4885KIT 500/4885

“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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