SCHEMBL2531879

SCHEMBL2531879

[CH2]c1ccc(OC(=O)N(CC)CC)cc1

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.81
KMT2A Q03164 1/20 0.81
HSD17B10 Q99714 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
LMNA P02545 4/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
MAOA P21397 4/20 0.51
SRD5A1 P18405 1/20 0.50
RAB9A P51151 1/20 0.48
MAOB P27338 2/20 0.45
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL9302685 0.90 MEN1 (1.00) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL5623889 0.85 MEN1 (0.88) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL2542317 0.84 MEN1 (0.56) MEN1KMT2AMAOARAB9AMAOB
SCHEMBL8945322 0.83 KMT2A (0.85) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL12928357 0.81 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL19439086 0.81 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL8945706 0.81 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL10013782 0.81 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL5623546 0.81 MEN1 (0.81) MEN1KMT2AHSD17B10SMN1; SMN2LMNA
SCHEMBL1495914 0.80 MEN1 (0.79) MEN1KMT2AHSD17B10SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044070-B2 Heteroaryloxy nitrogenous saturated heterocyclic derivative MSD K.K. (JP) 2011-10-25 US disclosed
US-20100210637-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE MSD K.K. (JP) 2010-08-19 US disclosed
US-7595316-B2 Heteroaryloxy nitrogenous saturated heterocyclic derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-09-29 US disclosed
US-20060178375-A1 Heteroaryloxy nitrogenous saturated heterocyclic derivative MSD K.K. (JP) 2006-08-10 US disclosed
EP-1642898-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-04-05 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 (2 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-20060178375-A1 Heteroaryloxy nitrogenous saturated heterocyclic derivative HRH3, HRH4, HCRTR2 MEN1 1981/4885KMT2A 423/4885HSD17B10 836/4885
US-20100210637-A1 HETEROARYLOXY NITROGENOUS SATURATED HETEROCYCLIC DERIVATIVE HRH3, HRH4, HRH2 MEN1 1602/4885KMT2A 552/4885HSD17B10 923/4885

“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.