SCHEMBL2593449

SCHEMBL2593449

COc1ccc(C2CCN(c3cccc(C(=O)N4CCC(C)CC4)n3)CC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPC6 Q9Y210 4/20 0.50
TRPC3 Q13507 2/20 0.50
HSD11B1 P28845 3/20 0.49
FAAH O00519 1/20 0.45
FASN P49327 2/20 0.44
HPGD P15428 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 1/20 0.42
MGLL Q99685 1/20 0.42

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
SCHEMBL12182407 0.87 GAA (0.57) TRPC6TRPC3HSD11B1GAALMNA
SCHEMBL2590236 0.87 HSD11B1 (0.53) TRPC6TRPC3HSD11B1FASNHPGD
SCHEMBL2591221 0.87 HSD11B1 (0.48) TRPC6HSD11B1FAAHHPGDLMNA
SCHEMBL2593742 0.85 HSD11B1 (0.58) TRPC6TRPC3HSD11B1HPGDLMNA
SCHEMBL2591255 0.80 HSD11B1 (0.56) TRPC6TRPC3HSD11B1HPGDLMNA
SCHEMBL12753333 0.78 HSD11B1 (0.60) TRPC6TRPC3HSD11B1HPGDLMNA
SCHEMBL2591502 0.78 HSD11B1 (0.67) HSD11B1HPGDTSHRNPC1RAB9A
SCHEMBL15188020 0.75 HSD11B1 (0.50) TRPC6TRPC3HSD11B1GAATSHR
SCHEMBL2593371 0.74 HSD11B1 (0.47) HSD11B1HPGDTSHRMAPT
SCHEMBL12183553 0.74 HSD11B1 (0.55) TRPC6TRPC3HSD11B1LMNANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130210811-A1 PICOLINAMIDE AND PYRIMIDINE-4-CARBOXAMIDE COMPOUNDS, PROCESS FOR PREPARING AND PHAMACEUTICAL COMPOSITION COMPRISING THE SAME SK CHEMICALS CO., LTD. (KR) 2013-08-15 US claimed
EP-2566859-A2 PICOLINAMIDE AND PYRIMIDINE-4-CARBOXAMIDE COMPOUNDS, PROCESS FOR PREPARING AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Sk Chemicals Co., Ltd. (KR) 2013-03-13 EP claimed
WO-2011139107-A2 PICOLINAMIDE AND PYRIMIDINE-4-CARBOXAMIDE COMPOUNDS, PROCESS FOR PREPARING AND PHAMACEUTICAL COMPOSITION COMPRISING THE SAME SK CHEMICALS CO.,LTD. (KR) 2011-11-10 WO claimed

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-20130210811-A1 PICOLINAMIDE AND PYRIMIDINE-4-CARBOXAMIDE COMPOUNDS, PROCESS FOR PREPARING AND PHAMACEUTICAL COMPOSITION COMPRISING THE SAME HSD11B1, HSD11B2, G6PC1 TRPC6 4676/4885TRPC3 4165/4885HSD11B1 1/4885

“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.