SCHEMBL10094667

SCHEMBL10094667

Cc1cccnc1-c1ccc(C(O)N2CCOCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IDH1 O75874 2/20 0.46
▸ TRPV1 Q8NER1 6/20 0.43
▸ CNR2 P34972 1/20 0.42
▸ CYP2A6 P11509 1/20 0.39
▸ BRAF P15056 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ PTBP1 P26599 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PRKDC P78527 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ P2RX7 Q99572 3/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ PIK3CG P48736 1/20 0.36

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
SCHEMBL10094626 0.79 ALDH1A1 (0.43) CNR2MAPK1P2RX7PIK3CDPIK3CA
SCHEMBL10094652 0.78 GAA (0.55) CNR2GAAMAPTMEN1PTBP1
SCHEMBL10094655 0.72 CYP2A6 (0.40) IDH1CNR2CYP2A6MEN1MAPK1
SCHEMBL10094723 0.72 TRPV1 (0.50) TRPV1CNR2CYP2A6KMT2A
SCHEMBL23080987 0.71 NPC1 (0.51) GAAMAPTMEN1MAPK1KMT2A
SCHEMBL15547627 0.70 KCNA5 (0.57) MAPTKMT2ASMN1; SMN2
SCHEMBL12052135 0.69 KDM4E (0.46) P2RX7
SCHEMBL10094706 0.69 KDM4E (0.41) P2RX7
SCHEMBL18827142 0.68 ALDH1A1 (0.58) MAPTTP53SMN1; SMN2P2RX7
SCHEMBL26386541 0.68 ALDH1A1 (0.42) MAPTKMT2ASMN1; SMN2

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-8148535-B2 Potassium channel inhibitors MERCK SHARP & DOHME CORP. (US) 2012-04-03 — — US disclosed
US-20090233897-A1 Potassium Channel Inhibitors MERCK SHARP & DOHME CORP. 2009-09-17 — — 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-20090233897-A1 Potassium Channel Inhibitors KCNJ2, KCNQ2, KCNH2 IDH1 2051/4885TRPV1 93/4885CNR2 2350/4885

“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.

Send feedback