SCHEMBL13086458

SCHEMBL13086458

CNC(=O)c1cncc(C(C)C)n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.40
BRD4 O60885 10/20 0.37
HPGD P15428 1/20 0.37
PDE10A Q9Y233 1/20 0.36
CDC7 O00311 1/20 0.36
DBF4 Q9UBU7 1/20 0.36
BAZ2B Q9UIF8 1/20 0.35
GRM5 P41594 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
CCNC P24863 1/20 0.33
CDK8 P49336 1/20 0.33

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
SCHEMBL24993310 0.84 P2RX7 (0.41) CNR1GRM5CYP1A2CYP3A4
SCHEMBL23015757 0.80 CNR1 (0.45) CNR1BRD4HPGDNPC1RAB9A
SCHEMBL1760148 0.79 KDM4E (0.41) HPGD
SCHEMBL29338003 0.79 CD38 (0.47) CNR1BRD4NPC1RAB9A
SCHEMBL12990143 0.79 MRGPRX4 (0.41) CYP1A2CYP3A4NPC1RAB9A
SCHEMBL31636273 0.78 ADORA3 (0.42) CDC7CCNCCDK8
SCHEMBL19151634 0.78 ADORA3 (0.42) CDC7CCNCCDK8
SCHEMBL164543 0.76 CNR1 (0.42) CNR1BRD4HPGDBAZ2BGRM5
SCHEMBL13097165 0.76 GRM5 (0.54) CNR1BRD4HPGDBAZ2BGRM5
SCHEMBL26986930 0.76 CNR1 (0.42) CNR1BRD4HPGDCDC7DBF4

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
US-8293769-B2 CSF-1R inhibitors, compositions, and methods of use NOVARTIS AG (CH) 2012-10-23 US disclosed
US-20100261679-A1 CSF-1R, Inhibitors, Compositions, and Methods of Use NOVARTIS AG (CH) 2010-10-14 US disclosed
US-20100130490-A1 CSF-1R INHIBITORS,COMPOSITIONS, AND METHODS OF USE NOVARTIS AG (CH) 2010-05-27 US disclosed
US-20100130490-A1 CSF-1R INHIBITORS,COMPOSITIONS, AND METHODS OF USE NOVARTIS AG (CH) 2010-05-27 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 (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-20100261679-A1 CSF-1R, Inhibitors, Compositions, and Methods of Use CSF1R, CSF3R, MSR1 CNR1 453/4885BRD4 2933/4885HPGD 1457/4885
US-20100130490-A1 CSF-1R INHIBITORS,COMPOSITIONS, AND METHODS OF USE CSF1R, CSF3R, FLT3 CNR1 398/4885BRD4 795/4885HPGD 1611/4885

“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.