SCHEMBL3669422

SCHEMBL3669422

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

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.33
HPGD P15428 1/20 0.32
PLAU P00749 1/20 0.32
BACE1 P56817 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
PTBP1 P26599 1/20 0.31
TSHR P16473 1/20 0.31
RECQL P46063 1/20 0.31
HRH4 Q9H3N8 1/20 0.31

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
SCHEMBL3666328 0.90 BACE1 (0.36) HPGDBACE1TSHRRECQLHRH4
SCHEMBL13007631 0.86 HRH4 (0.32) HPGDBACE1TSHRRECQLHRH4
SCHEMBL3669278 0.86 HRH4 (0.32) HPGDBACE1TSHRRECQLHRH4
SCHEMBL3780821 0.86 HRH4 (0.32) HPGDBACE1TSHRRECQLHRH4
SCHEMBL13007647 0.85 MAPK1 (0.33) CRHR1HPGDBACE1TSHRHRH4
SCHEMBL3668547 0.85 BACE1 (0.33) HPGDBACE1HRH4
SCHEMBL13007659 0.85 HRH4 (0.32) HPGDBACE1HRH4
SCHEMBL3676314 0.85 HRH4 (0.32) HPGDBACE1HRH4
SCHEMBL3669348 0.84 CRHR1 (0.31) CRHR1
SCHEMBL3768784 0.84 KDM4E (0.33) LMNAGAAPTBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 CRHR1 1998/4885HPGD 3712/4885PLAU 2228/4885

“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.