SCHEMBL3667902

SCHEMBL3667902

CCC(c1cccnc1)n1c(O)nc2ncc(Cl)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.35
MDM2 Q00987 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
ALOX12 P18054 1/20 0.35
HTT P42858 1/20 0.35
ESR2 Q92731 1/20 0.35
CYP19A1 P11511 1/20 0.35
CYP3A4 P08684 3/20 0.34
CYP3A5 P20815 1/20 0.34
LMNA P02545 2/20 0.34
KCNA5 P22460 4/20 0.33
POLB P06746 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KCND3 Q9UK17 1/20 0.33
APLNR P35414 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33

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
SCHEMBL3668127 0.90 CYP19A1 (0.35) TP53L3MBTL1KDM4EALDH1A1MAPT
SCHEMBL3672010 0.89 PPARG (0.36) L3MBTL1KDM4EALDH1A1HTTAPLNR
SCHEMBL3672349 0.85 CYP19A1 (0.37) HTTCYP19A1CYP3A4CYP3A5KCNA5
SCHEMBL3666716 0.78 BRD4 (0.40) L3MBTL1KDM4EALDH1A1HTT
SCHEMBL3667745 0.78 BRD4 (0.40) L3MBTL1KDM4EALDH1A1HTT
SCHEMBL3666328 0.77 BACE1 (0.36) HTTPOLB
SCHEMBL3670194 0.76 HRH4 (0.33) ALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL3669613 0.76 HRH4 (0.33) ALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL2300295 0.76 HRH4 (0.33) ALDH1A1HTTPOLBSMN1; SMN2
SCHEMBL3675313 0.75 MEN1 (0.40) TP53KDM4EALDH1A1LMNA

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-7851484-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2010-12-14 US claimed
EP-2139478-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS Cytokinetics, Incorporated (US) 2010-01-06 EP claimed
WO-2008121333-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-10-09 WO claimed
US-20080242695-A1 Certain Chemical Entities, Compositions, and Methods CYTOKINETICS, INC. 2008-10-02 US claimed
US-7851484-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2010-12-14 US disclosed
US-7851484-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2010-12-14 US disclosed
US-7851484-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2010-12-14 US disclosed
US-20080242695-A1 Certain Chemical Entities, Compositions, and Methods CYTOKINETICS, INC. 2008-10-02 US disclosed
US-20080242695-A1 Certain Chemical Entities, Compositions, and Methods CYTOKINETICS, INC. 2008-10-02 US disclosed
US-20080242695-A1 Certain Chemical Entities, Compositions, and Methods CYTOKINETICS, INC. 2008-10-02 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 (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-20080242695-A1 Certain Chemical Entities, Compositions, and Methods TNNC1, TNNI3, TNNT2 TP53 723/4885MDM2 2864/4885L3MBTL1 2636/4885

“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.