SCHEMBL3230699

SCHEMBL3230699

N#Cc1ccnc(C2CCOC2)c1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAP3K12 Q12852 13/20 0.53
LRRK2 Q5S007 2/20 0.39
CSF1R P07333 1/20 0.38
MAPK8 P45983 1/20 0.38
MAPK9 P45984 1/20 0.38
MAPK10 P53779 1/20 0.38
EGLN2 Q96KS0 3/20 0.37
PIM1 P11309 1/20 0.36

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
SCHEMBL16094779 0.82 MAP3K12 (0.43) MAP3K12EGLN2
SCHEMBL13738629 0.79 CTSK (0.41) MAP3K12CSF1RMAPK8MAPK9MAPK10
SCHEMBL22637348 0.79 DRD2 (0.41) MAP3K12CSF1RMAPK8MAPK9MAPK10
SCHEMBL3389679 0.79 CHRNA1 (0.42) MAP3K12EGLN2
SCHEMBL3394052 0.79 CHRNA1 (0.42) MAP3K12EGLN2
SCHEMBL13496621 0.78 CTSK (0.43) MAP3K12CSF1RMAPK8MAPK9MAPK10
SCHEMBL23365111 0.76 PIK3CD (0.36) MAP3K12MAPK8MAPK9MAPK10PIM1
SCHEMBL20676296 0.76 CCR1 (0.42) MAP3K12LRRK2PIM1
SCHEMBL23365116 0.76 PIK3CD (0.36) MAP3K12PIM1
SCHEMBL29979707 0.76 PIK3CD (0.36) MAP3K12PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458392-B9 ACRIDONES AS INHIBITORS OF IMPDH ENZYME BRISTOL MYERS SQUIBB CO (US) 2010-07-28 EP disclosed
EP-1458392-B1 ACRIDONES AS INHIBITORS OF IMPDH ENZYME BRISTOL MYERS SQUIBB CO (US) 2009-09-02 EP disclosed
US-7312209-B2 Acridone inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-25 US disclosed
EP-1458392-A4 ACRIDONE INHIBITORS OF IMPDH ENZYME BRISTOL MYERS SQUIBB CO (US) 2005-06-08 EP disclosed
EP-1458392-A2 ACRIDONE INHIBITORS OF IMPDH ENZYME Bristol-Myers Squibb Company (US) 2004-09-22 EP disclosed
US-20040053955-A1 Acridone inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY 2004-03-18 US disclosed
WO-2003059269-A2 ACRIDONE INHIBITORS OF IMPDH ENZYME BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-24 WO 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-20040053955-A1 Acridone inhibitors of IMPDH enzyme IMPDH2, IMPDH1, XDH MAP3K12 4552/4885LRRK2 2206/4885CSF1R 3965/4885

“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.