SCHEMBL482786

SCHEMBL482786

CC1CC(OC(N)=O)c2nc(Br)ccc2N1Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.42
BRD4 O60885 2/20 0.41
CACNA1G O43497 2/20 0.35
CACNA1H O95180 2/20 0.35
CACNA1I Q9P0X4 2/20 0.35
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TSHR P16473 1/20 0.34
CAPN1 P07384 1/20 0.34
NPSR1 Q6W5P4 3/20 0.33
KCNH2 Q12809 3/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
OPRK1 P41145 2/20 0.32

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
SCHEMBL483264 0.72 PTGDR2 (0.44) PTGDR2BRD4CACNA1GCACNA1HCACNA1I
SCHEMBL482790 0.71 PTGDR2 (0.39) PTGDR2BRD4CACNA1GCACNA1HCACNA1I
SCHEMBL482935 0.67 BRD4 (0.33) BRD4
SCHEMBL483269 0.67 NR3C2 (0.41) PTGDR2LMNAMAPT
SCHEMBL16722026 0.63 BRD4 (0.65) BRD4CACNA1GCACNA1HCACNA1I
SCHEMBL16722028 0.63 BRD4 (0.65) BRD4CACNA1GCACNA1HCACNA1I
SCHEMBL21261388 0.62 VRK1 (0.51) BRD4TSHRNPSR1MEN1MAPT
SCHEMBL15880160 0.61 HRH3 (0.47)
SCHEMBL30843731 0.61 MAPT (0.48) BRD4KCNH2MAPTOPRK1
SCHEMBL15875771 0.61 HRH3 (0.47)

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-8604030-B2 Fused piperidine compound and pharmaceutical containing same KOWA COMPANY, LTD. (JP) 2013-12-10 US disclosed
US-20120108581-A1 FUSED PIPERIDINE COMPOUND AND PHARMACEUTICAL CONTAINING SAME KOWA COMPANY, LTD (JP) 2012-05-03 US disclosed
EP-2412710-A1 FUSED PIPERIDINE COMPOUND AND PHARMACEUTICAL AGENT COMPRISING SAME Kowa Company, Ltd. (JP) 2012-02-01 EP 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-20120108581-A1 FUSED PIPERIDINE COMPOUND AND PHARMACEUTICAL CONTAINING SAME EPOR, JAK2, HBZ PTGDR2 120/4885BRD4 1271/4885CACNA1G 2684/4885

“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.