SCHEMBL2590539

SCHEMBL2590539

CC(Cl)C(=O)c1ccc2c(c1)oc(=O)n2Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MIF P14174 5/20 0.62
▸ NPC1 O15118 1/20 0.58
▸ CD74 P04233 2/20 0.52
▸ MAPT P10636 4/20 0.50
▸ TP53 P04637 3/20 0.50
▸ SIGMAR1 Q99720 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48

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
SCHEMBL2587145 0.88 MIF (0.59) MIFNPC1CD74MAPTTP53
SCHEMBL2587520 0.83 MIF (0.64) MIFNPC1CD74MAPTTP53
SCHEMBL2590366 0.83 MIF (0.56) MIFNPC1CD74MAPTTP53
SCHEMBL2587942 0.80 MIF (0.49) MIFNPC1CD74MAPTTP53
SCHEMBL2590197 0.78 MIF (0.53) MIFNPC1CD74MAPTTP53
SCHEMBL243468 0.77 MIF (1.00) MIFNPC1CD74TP53POLB
SCHEMBL2757855 0.77 MIF (0.70) MIFNPC1CD74POLBALDH1A1
SCHEMBL15712228 0.74 NPC1 (1.00) MIFNPC1CD74TP53SIGMAR1
SCHEMBL27378140 0.74 MIF (0.70) MIFNPC1CD74POLBMEN1
SCHEMBL13981986 0.74 MIF (0.65) MIFNPC1CD74MAPTTP53

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-2566864-B1 PYRIDAZINONES AS GPR119 AGONISTS BOEHRINGER INGELHEIM INT (DE) 2014-09-03 — — EP disclosed
US-8772323-B2 Benzoxazole- and tetrahydrobenzoxazole-substituted pyridazinones as GPR119 agonists BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-08 — — US disclosed
US-20130172323-A1 PYRIDAZINONES AS GPR119 AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-07-04 — — US disclosed
EP-2566864-A2 PYRIDAZINONES AS GPR119 AGONISTS Boehringer Ingelheim International GmbH (DE) 2013-03-13 — — EP disclosed
WO-2011138427-A2 PYRIDAZINONES AS GPR119 AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 — — 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-20130172323-A1 PYRIDAZINONES AS GPR119 AGONISTS GPR65, GPR119, GPR55 MIF 3416/4885NPC1 2612/4885CD74 823/4885

“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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