SCHEMBL9924343

SCHEMBL9924343

CCc1nnc2ccc([C@@H](C)O)nn12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.40
MET P08581 9/20 0.35
POLB P06746 2/20 0.35
TP53 P04637 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DPP4 P27487 1/20 0.32
DPP9 Q86TI2 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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
SCHEMBL9924344 1.00 BRD4 (0.40) BRD4METPOLBTP53SMN1; SMN2
SCHEMBL12891181 0.87 BRD4 (0.42) BRD4METPOLBTP53SMN1; SMN2
SCHEMBL2698542 0.80 TRPC5 (0.38) METPOLBTP53SMN1; SMN2LMNA
SCHEMBL9910523 0.74 POLB (0.42) BRD4POLBLMNAKDM4EMEN1
SCHEMBL19190552 0.74 POLB (0.42) BRD4POLBLMNAKDM4EMEN1
SCHEMBL31735817 0.73 KDM4E (0.58) BRD4METPOLBSMN1; SMN2KDM4E
SCHEMBL19631468 0.71 BRD4 (0.43) BRD4METPOLBTP53SMN1; SMN2
SCHEMBL9924340 0.70 BRD4 (0.42) BRD4METPOLBDPP4DPP9
SCHEMBL9924265 0.69 MET (0.45) BRD4METPOLBSMN1; SMN2DPP4
SCHEMBL9924342 0.69 MET (0.41) BRD4METPOLBKDM4EMEN1

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-9066954-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2015-06-30 US disclosed
US-20130303529-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC (US) 2013-11-14 US disclosed
US-8524900-B2 Fused heterocyclic derivatives and methods of use AMGEN INC. (US) 2013-09-03 US disclosed
US-20120148531-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-06-14 US disclosed
US-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-05-03 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 (3 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-20120148531-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET BRD4 3499/4885MET 3/4885POLB 1125/4885
US-20130303529-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET BRD4 3499/4885MET 3/4885POLB 1125/4885
US-20120107275-A1 FUSED HETEROCYCLIC DERIVATIVES AND METHODS OF USE HGF, HGFAC, MET BRD4 3499/4885MET 3/4885POLB 1125/4885

“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.