SCHEMBL11029882

SCHEMBL11029882

O=C(N1CCOCC1)n1[c]ccn1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.48
KMT2A Q03164 1/20 0.48
RECQL P46063 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
AKR1C3 P42330 7/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL751979 0.85 ALDH1A1 (0.41) MEN1TP53KMT2AALDH1A1
SCHEMBL24937762 0.72 MEN1 (0.52) MEN1TP53KMT2ARECQLKDM4E
SCHEMBL2899860 0.70 MEN1 (0.80) MEN1TP53KMT2ARECQLAKR1C3
SCHEMBL3954355 0.68 MEN1 (0.86) MEN1TP53KMT2ARECQLALDH1A1
SCHEMBL30677423 0.68 MEN1 (0.95) MEN1TP53KMT2ARECQLALDH1A1
SCHEMBL11741744 0.68 MEN1 (0.85) MEN1TP53KMT2ARECQLAKR1C3
Hydrochloric Acid SCHEMBL27660773 0.68 MEN1 (0.76) MEN1TP53KMT2ARECQLAKR1C3
Hydrochloric Acid SCHEMBL28000052 0.68 MEN1 (0.76) MEN1TP53KMT2ARECQLAKR1C3
SCHEMBL19078739 0.67 MEN1 (0.46) MEN1TP53KMT2AKDM4EALDH1A1
SCHEMBL3707539 0.67 MEN1 (0.46) MEN1TP53KMT2ARECQLAKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD MEN1 2197/4885TP53 558/4885KMT2A 2120/4885

“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.