SCHEMBL4273306

SCHEMBL4273306

COC(=O)C(C)N(Cc1cccc(OC)c1)c1ccc(F)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
MAPT P10636 1/20 0.49
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
MDM2 Q00987 1/20 0.41
GAA P10253 1/20 0.41
PTGES O14684 2/20 0.40
DPP4 P27487 1/20 0.40
HTT P42858 1/20 0.40
ALOX5 P09917 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL4273311 1.00 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4268251 0.91 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4268250 0.91 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4276753 0.90 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4276761 0.90 MEN1 (0.49) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
Lithium Ion SCHEMBL4276756 0.89 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4272601 0.88 UBE2M (0.42) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL4272537 0.88 UBE2M (0.42) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL13657710 0.81 ALDH1A1 (0.44) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL13657717 0.78 ATM (0.41) ALDH1A1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US disclosed
US-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US disclosed
US-7608739-B2 Mitotic kinesin inhibitors MERCK & CO. INC. (US) 2009-10-27 US disclosed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 US disclosed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 US disclosed
US-20080234281-A1 Mitotic Kinesin Inhibitors MERCK SHARP & DOHME CORP. 2008-09-25 US disclosed
EP-1730099-A4 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2008-03-12 EP disclosed
CN-1934066-A Mitotic kinesin inhibitors MERCK & CO INC (US) 2007-03-21 CN disclosed
EP-1730099-A2 MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2006-12-13 EP disclosed
WO-2005092011-A2 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2005-10-06 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-20080234281-A1 Mitotic Kinesin Inhibitors KIF5B, KIF2C, KIF18B MEN1 2079/4885KMT2A 302/4885MAPT 252/4885

“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.