SCHEMBL9102483

SCHEMBL9102483

CON(C)C(=O)c1ccc(C)c(NC(=O)OC(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.40
CYP17A1 P05093 2/20 0.39
NPSR1 Q6W5P4 2/20 0.38
LMNA P02545 2/20 0.38
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LCK P06239 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
SCHEMBL17025650 0.84 CYP17A1 (0.41) MLYCDCYP17A1POLBALDH1A1HDAC1
SCHEMBL25043894 0.84 CYP17A1 (0.54) MLYCDCYP17A1LMNACYP1A2CYP3A4
SCHEMBL10318265 0.82 ALDH1A1 (0.50) NPSR1LMNAPOLBGAAALDH1A1
SCHEMBL2283371 0.81 PPARG (0.51) LMNAGAAMAPK1ALDH1A1HDAC1
SCHEMBL9104625 0.81 CA12 (0.44) CYP17A1NPSR1LMNACYP1A2POLB
SCHEMBL8739566 0.80 CYP17A1 (0.49) MLYCDCYP17A1CA12CA1CA9
SCHEMBL11982645 0.79 HDAC1 (0.46) HDAC1HDAC8HDAC6LCK
SCHEMBL29626601 0.79 ATR (0.43) MLYCDCYP17A1
SCHEMBL6180657 0.79 ATR (0.43) MLYCDCYP17A1
SCHEMBL8739191 0.79 CYP17A1 (0.44) MLYCDCYP17A1CA12CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8563558-B2 Substituted pyridine urea compounds CONFLUENCE LIFE SCIENCES, INC. (US) 2013-10-22 US disclosed
WO-2012078673-A1 SUBSTITUTED PYRIDINE UREA COMPOUNDS CONFLUENCE LIFE SCIENCES, INC. (US) 2012-06-14 WO disclosed
US-20120142708-A1 SUBSTITUTED PYRIDINE UREA COMPOUNDS ACLARIS THERAPEUTICS, INC. 2012-06-07 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-20120142708-A1 SUBSTITUTED PYRIDINE UREA COMPOUNDS MAPK1, MAP3K1, MAP3K8 MLYCD 3932/4885CYP17A1 3235/4885NPSR1 3522/4885

“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.