SCHEMBL15395673

SCHEMBL15395673

CC(=O)C[C@@H](NC(=O)OCc1ccccc1)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.54
ELANE P08246 2/20 0.54
TRPM8 Q7Z2W7 1/20 0.53
CTSK P43235 4/20 0.52
CTRB1 P17538 2/20 0.51
PRTN3 P24158 2/20 0.51
CTSS P25774 4/20 0.50
CTSL P07711 3/20 0.50
ALDH1A1 P00352 2/20 0.50
CTSB P07858 2/20 0.50
ALOX15 P16050 1/20 0.50
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL9749127 0.90 ATM (0.56) ATMELANETRPM8CTSKCTRB1
SCHEMBL19859590 0.90 ATM (0.56) ATMELANETRPM8CTSKCTRB1
SCHEMBL3202235 0.90 ATM (0.56) ATMELANETRPM8CTSKCTRB1
SCHEMBL9937088 0.87 TRPM8 (0.55) ATMELANETRPM8CTSKCTRB1
SCHEMBL6044625 0.87 PSMB1 (0.58) ATMELANETRPM8CTSKCTRB1
SCHEMBL6044628 0.87 PSMB1 (0.58) ATMELANETRPM8CTSKCTRB1
SCHEMBL6044396 0.87 PSMB1 (0.58) ATMELANETRPM8CTSKCTRB1
SCHEMBL9937089 0.87 TRPM8 (0.55) ATMELANETRPM8CTSKCTRB1
SCHEMBL6044481 0.86 ATM (0.52) ATMELANETRPM8CTSKCTRB1
SCHEMBL8682643 0.86 ATM (0.52) ATMELANETRPM8CTSKCTRB1

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-9029343-B2 Modulators of histone methyltransferase, and methods of use thereof Epizyme, Inc. (US) 2015-05-12 US disclosed
US-20130310333-A1 Modulators of Histone Methyltransferase, and Methods of Use Thereof Epizyme, Inc. (US) 2013-11-21 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-20130310333-A1 Modulators of Histone Methyltransferase, and Methods of Use Thereof EHMT1, EHMT2, HNMT ATM 856/4885ELANE 1284/4885TRPM8 4367/4885

“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.