SCHEMBL4063794

SCHEMBL4063794

CCOC(=O)c1ccsc1NC(=O)Nc1ccc(C)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 2/20 0.54
MAPK14 Q16539 2/20 0.53
RAF1 P04049 1/20 0.53
PKM P14618 1/20 0.52
ATM Q13315 1/20 0.52
KMT2A Q03164 8/20 0.50
MEN1 O00255 7/20 0.50
ALDH1A1 P00352 5/20 0.50
HPGD P15428 1/20 0.50
NPSR1 Q6W5P4 2/20 0.49
GAA P10253 2/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 2/20 0.49
MAPT P10636 5/20 0.49
CASP3 P42574 1/20 0.49
TRPV1 Q8NER1 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 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
SCHEMBL4911102 0.86 MAPT (0.59) KMT2AMEN1ALDH1A1GAAKDM4E
SCHEMBL4921736 0.84 MAPT (0.59) KMT2AMEN1ALDH1A1GAAMAPT
SCHEMBL9396580 0.83 MEN1 (0.48) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL9398335 0.82 PKM (0.47) PKMKMT2AMEN1ALDH1A1HPGD
SCHEMBL11638233 0.80 PTK2 (0.59) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL15440489 0.79 HPGD (0.53) KMT2AMEN1ALDH1A1HPGDKDM4E
SCHEMBL10734797 0.78 MEN1 (0.43) KMT2AMEN1ALDH1A1HPGDNPSR1
SCHEMBL4113307 0.77 MAPT (0.77) KMT2AMEN1ALDH1A1GAAPOLB
SCHEMBL10728971 0.76 MEN1 (0.42) KMT2AMEN1ALDH1A1HPGDNPSR1
SCHEMBL31469754 0.76 MEN1 (0.50) KMT2AMEN1ALDH1A1HPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697381-A4 MITOTIC KINESIN INHIBITORS MERCK & CO INC (US) 2009-03-11 EP disclosed
US-20070149553-A1 Mitotic kinesin inhibitors ARRINGTON KENNETH L 2007-06-28 US disclosed
US-20070149553-A1 Mitotic kinesin inhibitors ARRINGTON KENNETH L 2007-06-28 US disclosed
US-20070149553-A1 Mitotic kinesin inhibitors ARRINGTON KENNETH L 2007-06-28 US disclosed
EP-1697381-A1 MITOTIC KINESIN INHIBITORS Merck & Co., Inc. (US) 2006-09-06 EP disclosed
WO-2005061518-A1 MITOTIC KINESIN INHIBITORS MERCK & CO., INC. (US) 2005-07-07 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-20070149553-A1 Mitotic kinesin inhibitors KIF5B, KIF2C, KIF18B TLR2 4878/4885MAPK14 1949/4885RAF1 2005/4885

“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.