SCHEMBL10119030

SCHEMBL10119030

[3H]CC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
FABP5 Q01469 3/20 0.50
FABP7 O15540 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
EPHX2 P34913 1/20 0.48
POLB P06746 1/20 0.46
CASP3 P42574 1/20 0.43
HTR2A P28223 1/20 0.40

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
SCHEMBL410205 0.88 KMT2A (0.55) KMT2AFABP5FABP7CA1CA2
SCHEMBL29608029 0.88 KMT2A (0.55) KMT2AFABP5FABP7CA1CA2
SCHEMBL14300992 0.83 KMT2A (0.51) KMT2AFABP5FABP7CA1CA2
SCHEMBL44676 0.80 KMT2A (0.58) KMT2AFABP5FABP7CA1CA2
SCHEMBL15981181 0.80 KMT2A (0.58) KMT2AFABP5FABP7CA1CA2
SCHEMBL44677 0.79 FABP5 (0.59) KMT2AFABP5FABP7CA1CA2
SCHEMBL12016740 0.79 KMT2A (0.56) KMT2AFABP5FABP7CA1CA2
SCHEMBL29901230 0.79 FABP5 (0.59) KMT2AFABP5FABP7CA1CA2
SCHEMBL2782675 0.79 KMT2A (0.56) KMT2AFABP5FABP7CA1CA2
SCHEMBL29381061 0.79 FABP5 (0.59) KMT2AFABP5FABP7CA1CA2

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-20130029901-A1 METHODS AND COMPOUNDS FOR THE TARGETED DELIVERY OF AGENTS TO BONE FOR INTERACTION THEREWITH Pradama, Inc. 2013-01-31 US disclosed
US-20120083440-A1 METHODS AND COMPOUNDS FOR THE TARGETED DELIVERY OF AGENTS TO BONE FOR INTERACTION THEREWITH Pradama, Inc. 2012-04-05 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-20120083440-A1 METHODS AND COMPOUNDS FOR THE TARGETED DELIVERY OF AGENTS TO BONE FOR INTERACTION THEREWITH BMP2, SOST, BMP4 KMT2A 3983/4885FABP5 1102/4885FABP7 699/4885
US-20130029901-A1 METHODS AND COMPOUNDS FOR THE TARGETED DELIVERY OF AGENTS TO BONE FOR INTERACTION THEREWITH BMP2, SOST, BMP4 KMT2A 3983/4885FABP5 1102/4885FABP7 699/4885

“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.