Enmd-981693

Enmd-981693

SCHEMBL608128

Cn1cc(C2=C(c3cn(C)c4cc([N+](=O)[O-])ccc34)C(=O)NC2=O)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

AURKABLKFGFR1FGFR2FGFR3FGFR4FGRFLT3FRKFYNHCKKDRLCKLYNPDGFRAPDGFRBSRCSRMSYES1

The experimentally established mechanism targets of Enmd-981693. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 1/20 0.69
CDK4 P11802 1/20 0.69
CCND1 P24385 1/20 0.69
CCNE1 P24864 1/20 0.69
CDK2 P24941 1/20 0.69
GSK3B P49841 1/20 0.59

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
Enmd-981693 SCHEMBL29350364 1.00 CCNE2 (0.69) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL668748 0.94 CCNE2 (0.57) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL8167814 0.93 CCNE2 (0.69) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6440413 0.92 CCNE2 (0.58) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL7508119 0.92 CCNE2 (0.56) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6427037 0.90 CCNE2 (0.57) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6438493 0.90 CCNE2 (0.55) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6425996 0.90 CCNE2 (0.55) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6425702 0.89 CCNE2 (0.54) CCNE2CDK4CCND1CCNE1CDK2
SCHEMBL6424448 0.89 CCNE2 (0.54) CCNE2CDK4CCND1CCNE1CDK2

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 168 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1242408-B1 SUBSTITUTED BISINDOLYLMALEIMIDES FOR THE INHIBITION OF CELL PROLIFERATION HOFFMANN LA ROCHE (CH) 2005-10-12 EP claimed
US-RE36736-E Substituted pyrroles HOFFMAN-LA ROCHE INC. (US) 2000-06-13 US claimed
US-20190185572-A1 COMBINATION THERAPY OF ANTIBODIES AGAINST HUMAN CSF-1R AND USES THEREOF HOFFMANN-LA ROCHE INC. (US) 2019-06-20 US disclosed
EP-3330292-A1 HUMAN C-FMS ANTIGEN BINDING PROTEINS Amgen, Inc (US) 2018-06-06 EP disclosed
US-9988457-B2 Human C-FMS antigen binding proteins AMGEN INC. (US) 2018-06-05 US disclosed
EP-2188313-B1 HUMAN C-FMS ANTIGEN BINDING PROTEINS AMGEN INC (US) 2017-11-01 EP disclosed
US-20170247459-A1 COMBINATION THERAPY OF ANTIBODIES AGAINST HUMAN CSF-1R AND USES THEREOF HOFFMANN-LA ROCHE INC. (US) 2017-08-31 US disclosed
US-20160340434-A1 HUMAN C-FMS ANTIGEN BINDING PROTEINS AMGEN INC. (US) 2016-11-24 US disclosed
US-9353218-B2 Kit for multifunctional compounds forming crosslinked biomaterials ANGIOTECH PHARMACEUTICALS, INC. 2016-05-31 US disclosed
EP-1922337-B1 TRAIL RECEPTOR 2 POLYPEPTIDES AND ANTIBODIES AMGEN INC (US) 2015-05-06 EP disclosed
EP-2822588-A1 COMBINATION THERAPY OF ANTIBODIES AGAINST HUMAN CSF-1R AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2015-01-14 EP disclosed
US-20020061922-A1 Amorphous form of cell cycle inhibitor having improved solubility and bioavailability ALBANO ANTONIO A (US) 2002-05-23 US disclosed
WO-2002028855-A2 AMORPHOUS FORM OF CELL CYCLE INHIBITOR F. HOFFMANN-LA ROCHE AG (CH) 2002-04-11 WO disclosed
US-6326501-B1 USING BASIC CATALYSTS; ENZYME INHIBITORS HOFFMANN-LA ROCHE INC. 2001-12-04 US disclosed
WO-2001081305-A2 METHYLATION OF INDOLE COMPOUNDS USING DIMETHY CARBONATE F. HOFFMANN-LA ROCHE AG (CH) 2001-11-01 WO disclosed
WO-2001027106-A1 SUBSTITUTED PYRROLES AS ANTIPROLIFERATIVE AGENTS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2001-04-19 WO disclosed
US-RE36736-E Substituted pyrroles HOFFMAN-LA ROCHE INC. (US) 2000-06-13 US disclosed
EP-0328026-B1 SUBSTITUTED PYRROLES F. HOFFMANN-LA ROCHE AG (CH) 1993-04-28 EP disclosed
US-5057614-A Antiinflammatory, immunology, bronchodilator agents, cardiovascular disorders HOFFMANN-LA ROCHE INC. (US) 1991-10-15 US disclosed
EP-0328026-A1 Substituted pyrroles F. HOFFMANN-LA ROCHE AG (CH) 1989-08-16 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-20020061922-A1 Amorphous form of cell cycle inhibitor having improved solubility and bioavailability CCNI, CDKN1A, CCNB1 CCNE2 23/4885CDK4 39/4885CCND1 13/4885

“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.