SCHEMBL4237349

SCHEMBL4237349

CCS(=O)(=O)N1CCN(Cc2ccc(F)c(CNC(=O)Nc3ccc(C(C)=O)nc3)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 9/20 0.41
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.38
PRKAA2 P54646 3/20 0.38
CHRM1 P11229 1/20 0.37
HTR2A P28223 1/20 0.37
MCHR1 Q99705 1/20 0.37
SCN1A P35498 1/20 0.37
SCN5A Q14524 1/20 0.37
SCN8A Q9UQD0 1/20 0.37
CSF1R P07333 1/20 0.37
FLT3 P36888 1/20 0.37
LMNA P02545 1/20 0.37
CYP2D6 P10635 1/20 0.37
PKM P14618 1/20 0.37
CYP2C19 P33261 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37

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
SCHEMBL3733024 0.90 NAMPT (0.47) NAMPTKDM4ECYP2D6PKMCYP2C19
SCHEMBL3733007 0.88 NAMPT (0.41) NAMPTALDH1A1KDM4ESCN1ASCN5A
SCHEMBL3726868 0.87 NAMPT (0.45) NAMPTALDH1A1LMNA
SCHEMBL3733586 0.87 ALDH1A1 (0.45) NAMPTALDH1A1KDM4EPRKAA2
SCHEMBL4241314 0.87 NAMPT (0.49) NAMPTKDM4EPRKAA2
SCHEMBL3738408 0.85 KDM4E (0.43) NAMPTALDH1A1KDM4ECHRM1HTR2A
SCHEMBL3732488 0.85 NAMPT (0.44) NAMPTALDH1A1KDM4ELMNA
SCHEMBL3743486 0.83 NAMPT (0.49) NAMPT
SCHEMBL3738335 0.83 PIK3CA (0.47) NAMPTALDH1A1KDM4E
SCHEMBL3738643 0.82 KDM4E (0.37) ALDH1A1KDM4EPRKAA2MCHR1LMNA

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
US-20090247544-A1 Certain Chemical Entities, Compositions and Methods CYTOKINETICS, INC. 2009-10-01 US claimed
EP-1959947-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS Cytokinetics, Inc. (US) 2008-08-27 EP claimed
US-20070197505-A1 Certain chemical entities, compositions and methods CYTOKINETICS, INC. 2007-08-23 US claimed
WO-2007075377-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2007-07-05 WO claimed
US-20090247544-A1 Certain Chemical Entities, Compositions and Methods CYTOKINETICS, INC. 2009-10-01 US disclosed
US-20070197505-A1 Certain chemical entities, compositions and methods CYTOKINETICS, INC. 2007-08-23 US 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 (2 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-20070197505-A1 Certain chemical entities, compositions and methods TNNC1, TNNI3, TNNT2 NAMPT 2884/4885ALDH1A1 4108/4885KDM4E 3852/4885
US-20090247544-A1 Certain Chemical Entities, Compositions and Methods TNNC1, TNNI3, TNNT2 NAMPT 2884/4885ALDH1A1 4108/4885KDM4E 3852/4885

“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.