SCHEMBL1632050

SCHEMBL1632050

COC(=O)c1ccc(Cl)nc1NCCc1cccc(F)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CNR1 P21554 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
CSNK2A2 P19784 2/20 0.43
CSNK2A1 P68400 2/20 0.43
PLA2G2A P14555 2/20 0.43
RPS6KB1 P23443 2/20 0.42
AKT1 P31749 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
GPR84 Q9NQS5 1/20 0.42

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
Hydrochloric Acid SCHEMBL1632611 0.99 KDM4E (0.44) KDM4EL3MBTL1ALDH1A1HPGDMAPK1
SCHEMBL1630246 0.87 CSNK2A2 (0.49) KDM4EL3MBTL1CNR1TAAR1CSNK2A2
SCHEMBL1885184 0.80 RPS6KB1 (0.42) KDM4EL3MBTL1ALDH1A1HPGDMAPK1
SCHEMBL25310655 0.79 SMN1; SMN2 (0.49) KDM4EALDH1A1HPGDMAPK1SMN1; SMN2
SCHEMBL1633004 0.78 ALDH1A1 (0.45) KDM4EL3MBTL1ALDH1A1HPGDMAPK1
SCHEMBL1630794 0.78 GBA1 (0.48) KDM4EL3MBTL1ALDH1A1HPGDMAPK1
Hydrochloric Acid SCHEMBL1881988 0.77 GBA1 (0.48) KDM4EL3MBTL1ALDH1A1HPGDMAPK1
SCHEMBL1632979 0.76 MAPK1 (0.47) KDM4EL3MBTL1ALDH1A1HPGDMAPK1
SCHEMBL3385212 0.76 KDM4E (0.55) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL12765141 0.76 CSNK2A2 (0.49) KDM4EL3MBTL1ALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932270-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2011-04-26 US disclosed
US-7932270-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2011-04-26 US disclosed
US-7932270-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2011-04-26 US disclosed
US-20090012126-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-01-08 US disclosed
US-20090012126-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-01-08 US disclosed
US-20090012126-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-01-08 US disclosed
WO-2008016643-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-02-07 WO disclosed
WO-2008016643-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-02-07 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-20090012126-A1 Certain chemical entities, compositions, and methods MYLK, MYH2, MYH10 KDM4E 3309/4885L3MBTL1 4674/4885ALDH1A1 1756/4885

“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.