SCHEMBL4719735

SCHEMBL4719735

CON(C)C(=O)c1cc(C)cc(C)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TPMT P51580 1/20 0.46
MLYCD O95822 1/20 0.45
CLK1 P49759 1/20 0.41
DYRK1A Q13627 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
ABCB1 P08183 3/20 0.38
SLC7A5 Q01650 1/20 0.38
ICAM1 P05362 1/20 0.37
SELE P16581 1/20 0.37
CNR2 P34972 2/20 0.37
HCAR1 Q9BXC0 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.36
ATM Q13315 1/20 0.36
HPGD P15428 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
SCHEMBL6493529 0.96 MLYCD (0.45) TPMTMLYCDCLK1DYRK1ADYRK1B
SCHEMBL13898624 0.89 MLYCD (0.41) TPMTMLYCDCLK1DYRK1ADYRK1B
SCHEMBL14752329 0.87 MLYCD (0.40) TPMTMLYCDCLK1DYRK1ADYRK1B
SCHEMBL13307506 0.87 SLC7A5 (0.50) MLYCDSLC7A5CNR2ATM
SCHEMBL3716405 0.87 MLYCD (0.43) TPMTMLYCDCLK1DYRK1ADYRK1B
SCHEMBL12563345 0.83 MLYCD (0.50) MLYCDGPBAR1
SCHEMBL15031023 0.83 MLYCD (0.43) TPMTMLYCDCLK1DYRK1ADYRK1B
SCHEMBL17321003 0.83 KAT6A (0.43) TPMTMLYCDCLK1DYRK1ADYRK1B
SCHEMBL20632883 0.82 TSHR (0.50) ATMHPGD
SCHEMBL6481629 0.82 ATM (0.46) MLYCDCNR2ATMHPGD

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-20190134005-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARM INC (US) 2019-05-09 US disclosed
WO-2017214505-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE BIOMARIN PHARMACEUTICAL INC. (US) 2017-12-14 WO disclosed
EP-1953147-A1 HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF Japan Tobacco, Inc. (JP) 2008-08-06 EP disclosed
US-7273863-B1 Benzophenones as inhibitors of reverse transcriptase SMITHKLINE BEECHAM CORPORATION (US) 2007-09-25 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-20190134005-A1 CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE UGCG, MAN2B1, GBA1 TPMT 255/4885MLYCD 524/4885CLK1 1467/4885

“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.