SCHEMBL10697750

SCHEMBL10697750

CCN(CC)C(=O)Oc1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
KDM4E B2RXH2 2/20 0.50
HSD17B10 Q99714 2/20 0.48
LMNA P02545 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TSHR P16473 1/20 0.47
TSPO P30536 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
TRPM8 Q7Z2W7 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
SCHEMBL9069782 0.81 POLB (0.48) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL27600746 0.81 TSHR (0.43) MEN1KMT2AKDM4ELMNAL3MBTL1
Hydrochloric Acid SCHEMBL29361741 0.79 RAB9A (0.47) KMT2AKDM4ELMNATSHRTSPO
SCHEMBL26619124 0.78 TRPM8 (0.49) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL2218296 0.78 ALDH1A1 (0.39) KDM4ELMNAL3MBTL1TSHRSMN1; SMN2
SCHEMBL30571184 0.77 ALDH1A1 (0.45) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL4699526 0.77 MEN1 (0.53) MEN1KMT2AKDM4EHSD17B10LMNA
SCHEMBL4996914 0.77 ALDH1A1 (0.45) MEN1KMT2ALMNATSHRSMN1; SMN2
SCHEMBL5228241 0.76 MEN1 (0.49) MEN1KMT2AKDM4EHSD17B10LMNA
Bromide SCHEMBL28268585 0.76 ALDH1A1 (0.44) MEN1KMT2ALMNATSHRSMN1; SMN2

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-9567307-B2 Amination of aryl alcohol derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-14 US disclosed
US-9567307-B2 Amination of aryl alcohol derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-02-14 US disclosed
US-20130289270-A1 Amination of Aryl Alcohol Derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-31 US disclosed
US-20130289270-A1 Amination of Aryl Alcohol Derivatives THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2013-10-31 US disclosed
EP-0276204-A2 Pyridine gametocides Monsanto Company (US) 1988-07-27 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-20130289270-A1 Amination of Aryl Alcohol Derivatives SULT2A1, SULT1A1, ADH5 MEN1 4461/4885KMT2A 122/4885KDM4E 177/4885

“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.