SCHEMBL3667672

SCHEMBL3667672

CCC(CC)n1c(O)nc2nc(Cl)ccc21

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.37
BACE1 P56817 6/20 0.34
DHFR P00374 3/20 0.32
SLC2A1 P11166 1/20 0.32
CTSD P07339 1/20 0.30
KCNH2 Q12809 1/20 0.30
BACE2 Q9Y5Z0 1/20 0.30

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
SCHEMBL3674768 0.83 DHFR (0.35) BACE1DHFRSLC2A1
SCHEMBL3669091 0.77 HRH4 (0.32) BACE1
SCHEMBL3666328 0.76 BACE1 (0.36) BACE1
SCHEMBL3669610 0.76 PGR (0.32) BACE1DHFRSLC2A1
SCHEMBL3665285 0.75 KMT2A (0.39) BACE1
SCHEMBL2286829 0.75 BACE1 (0.32) PTGER4BACE1DHFRSLC2A1
SCHEMBL976331 0.74 CYP1A2 (0.34)
SCHEMBL3667046 0.73 SMN1; SMN2 (0.33) PTGER4
SCHEMBL3669395 0.72 DHFR (0.33) BACE1DHFRSLC2A1
SCHEMBL3665844 0.72 DHFR (0.34) DHFRSLC2A1

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 4 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 disclosed
EP-2139478-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS Cytokinetics, Incorporated (US) 2010-01-06 EP disclosed
WO-2008121333-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-10-09 WO 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 PTGER4 2978/4885BACE1 3389/4885DHFR 658/4885

“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.