SCHEMBL3667905

SCHEMBL3667905

Oc1nc2ncc(Cl)cc2n1CCCc1cccnc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.39
CYP2A6 P11509 1/20 0.39
SRC P12931 1/20 0.38
GABRA5 P31644 2/20 0.38
GABRA1 P14867 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TBXAS1 P24557 5/20 0.38
HRH1 P35367 2/20 0.37

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
SCHEMBL3668536 0.93 SRC (0.40) GRM2SRCGABRA5GABRA1L3MBTL1
SCHEMBL3667987 0.80 CYP19A1 (0.38) TDP1L3MBTL1HRH1
SCHEMBL3671987 0.78 NUDT1 (0.45)
SCHEMBL3669844 0.76 ALDH1A1 (0.53) GRM2SRCTDP1L3MBTL1
SCHEMBL3670195 0.76 KDM4E (0.40) TDP1
SCHEMBL3666329 0.75 TLR8 (0.37)
SCHEMBL3677182 0.75 CYP3A4 (0.41) HRH1
SCHEMBL3668071 0.75 HPGD (0.38) GRM2TDP1
SCHEMBL3675941 0.75 KMT2A (0.42)
SCHEMBL3667095 0.74 PSEN1 (0.39)

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 GRM2 2474/4885CYP2A6 4498/4885SRC 2518/4885

“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.