SCHEMBL3667095

SCHEMBL3667095

CCCCCCCn1c(O)nc2ncc(Cl)cc21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 7/20 0.39
PSEN2 P49810 7/20 0.39
APH1B Q8WW43 7/20 0.39
NCSTN Q92542 7/20 0.39
APH1A Q96BI3 7/20 0.39
PSENEN Q9NZ42 7/20 0.39
TLR8 Q9NR97 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ENPP2 Q13822 1/20 0.35
HRH4 Q9H3N8 2/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL3666329 0.99 TLR8 (0.37) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3670195 0.94 KDM4E (0.40) KDM4EMEN1ALDH1A1GAAKMT2A
SCHEMBL3668071 0.90 HPGD (0.38) KDM4EHRH4
SCHEMBL3671478 0.85 TLR8 (0.45) TLR8KDM4EMEN1ALDH1A1GAA
SCHEMBL3671987 0.85 NUDT1 (0.45) KMT2AHRH4
SCHEMBL3669397 0.85 ALDH1A1 (0.41) TLR8KDM4EMEN1ALDH1A1GAA
SCHEMBL3669424 0.84 PLAU (0.37) GAAKMT2ASMN1; SMN2HRH4
SCHEMBL3673651 0.83 APOBEC3G (0.38) KDM4EALDH1A1HRH4
SCHEMBL3672462 0.83 HRH4 (0.36) HRH4
SCHEMBL3675495 0.83 HRH4 (0.41) HRH4

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-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-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 PSEN1 857/4885PSEN2 1223/4885APH1B 1993/4885

“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.