SCHEMBL1386409

SCHEMBL1386409

[O]CC(=O)NCc1nc2ccccc2[nH]1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
POLB P06746 2/20 0.61
RAB9A P51151 2/20 0.61
SMN1; SMN2 Q16637 3/20 0.60
TSHR P16473 2/20 0.60
MAPK10 P53779 2/20 0.60
KDM4E B2RXH2 4/20 0.57
ALDH1A1 P00352 3/20 0.57
KMT2A Q03164 1/20 0.57
PKM P14618 1/20 0.56
MAPT P10636 2/20 0.56
HTT P42858 2/20 0.56
GAA P10253 2/20 0.54
CHRM1 P11229 1/20 0.54
HSD17B10 Q99714 1/20 0.54

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
SCHEMBL1386414 0.88 LMNA (0.62) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL8288446 0.87 LMNA (0.60) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL12201106 0.87 SMN1; SMN2 (0.75) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL17309673 0.85 LMNA (0.59) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL305355 0.84 POLB (0.64) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL8278816 0.84 SMN1; SMN2 (0.60) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL7977173 0.83 POLB (0.63) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL3915446 0.83 POLB (0.63) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL12851299 0.83 HTT (0.74) LMNAPOLBRAB9ASMN1; SMN2TSHR
SCHEMBL12201101 0.83 LMNA (0.57) LMNAPOLBRAB9ASMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4838121-B2 2011-12-14 JP claimed
EP-1641764-B1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS NOVARTIS AG (CH) 2011-07-27 EP claimed
EP-2298743-A1 5-membered heterocycle-based P38 kinase inhibitors Novartis AG (CH) 2011-03-23 EP claimed
JP-2007521278-A 2007-08-02 JP claimed
EP-1641764-A1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS Novartis AG (CH) 2006-04-05 EP claimed
US-20050049288-A1 5-MEMBERED HETEROCYCLE-BASED p38 KINASE INHIBITORS MEREO BIOPHARMA 1 LIMINTED (GB) 2005-03-03 US claimed
WO-2005009973-A1 5-MEMBERED HETEROCYCLE-BASED P38 KINASE INHIBITORS NOVARTIS AG (CH) 2005-02-03 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-20050049288-A1 5-MEMBERED HETEROCYCLE-BASED p38 KINASE INHIBITORS MAPK1, MAP3K1, MAP3K8 LMNA 2572/4885POLB 1686/4885RAB9A 1157/4885

“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.