SCHEMBL13611768

SCHEMBL13611768

CCOC(=O)c1c(-c2ccc(-c3ccsc3)cc2)c(C#N)cn1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
KDM4E B2RXH2 3/20 0.41
CHEK2 O96017 1/20 0.41
HSD17B10 Q99714 3/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 3/20 0.41
POLB P06746 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
USP2 O75604 1/20 0.41
ALOX15 P16050 1/20 0.41
HPGD P15428 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CDC7 O00311 1/20 0.40
DBF4 Q9UBU7 1/20 0.40

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
SCHEMBL8288366 0.85 KDM4E (0.53) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL8287323 0.84 GRIA2 (0.46) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL8289444 0.84 GRIA4 (0.41) NR4A2DRD2DRD3P2RX3
SCHEMBL4377035 0.84 FNTA (0.47) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL8289279 0.83 KDM4E (0.44) KDM4EMAPTALDH1A1POLBMEN1
SCHEMBL4374450 0.83 HTT (0.48) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL8289281 0.82 KDM4E (0.49) KDM4EHSD17B10MAPTALDH1A1MEN1
SCHEMBL4373029 0.82 KDM4E (0.40) KDM4EHSD17B10MAPTALDH1A1MEN1
SCHEMBL8289312 0.82 ALDH1A1 (0.45) HRH2HRH1KDM4EMAPTALDH1A1
SCHEMBL13611594 0.81 KDM4E (0.42) KDM4EHSD17B10MAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7625932-B2 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-12-01 US disclosed
US-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY 2007-03-22 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-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors GRIN1, GRIN3A, GRIK5 HRH2 1897/4885HRH1 1564/4885KDM4E 2620/4885

“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.