SCHEMBL12333392

SCHEMBL12333392

CCc1ccccc1C(=O)NCCN1CCCC1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
KDM4E B2RXH2 1/20 0.55
LMNA P02545 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
APP P05067 1/20 0.54
GLA P06280 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 2/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51

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
SCHEMBL19849358 0.88 MEN1 (0.52) POLBMEN1KMT2AKDM4ELMNA
SCHEMBL20879965 0.87 MEN1 (0.54) POLBMEN1KMT2AKDM4ELMNA
SCHEMBL18588486 0.84 KDM4E (0.49) POLBMEN1KMT2AKDM4ELMNA
SCHEMBL24333908 0.84 NPSR1 (0.56) POLBMEN1KMT2ANPSR1ALDH1A1
SCHEMBL13164061 0.84 NPSR1 (0.59) POLBMEN1KMT2ANPSR1ALDH1A1
SCHEMBL18588483 0.83 MEN1 (0.51) POLBMEN1KMT2AKDM4ELMNA
SCHEMBL26506323 0.83 MEN1 (0.53) POLBMEN1KMT2AKDM4ELMNA
SCHEMBL21883952 0.83 NPSR1 (0.52) POLBMEN1KMT2ANPSR1APP
SCHEMBL21347710 0.83 POLB (0.55) POLBMEN1KMT2AKDM4ENPSR1
SCHEMBL13164063 0.83 NPSR1 (0.58) POLBMEN1KMT2AKDM4ENPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8022222-B2 Glucokinase activators ARRAY BIOPHARMA, INC. (US) 2011-09-20 US disclosed
US-20090247526-A1 GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2009-10-01 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-20090247526-A1 GLUCOKINASE ACTIVATORS GCKR, GCK, GALK1 POLB 2674/4885MEN1 3595/4885KMT2A 2715/4885

“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.