SCHEMBL102476

SCHEMBL102476

CC(C)Oc1ccc(C2(C)NC(=O)NC2=O)nc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.42
TNF P01375 1/20 0.39
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.36
TLK2 Q86UE8 2/20 0.36
ACACB O00763 2/20 0.36
LRRK2 Q5S007 1/20 0.36
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
ABL1 P00519 1/20 0.34

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
SCHEMBL30412804 1.00 KMT2A (0.45) KMT2AMEN1LMNATNFKDM4E
SCHEMBL103835 0.79 LMNA (0.56) KMT2AMEN1LMNAKDM4EGAA
SCHEMBL102335 0.78 MMP13 (0.44) KMT2AMEN1LMNATNF
SCHEMBL1093500 0.75 LMNA (0.43) KMT2AMEN1LMNATNFKDM4E
SCHEMBL103911 0.74 LMNA (0.51) KMT2AMEN1LMNAKDM4EGAA
SCHEMBL543066 0.72 MEN1 (0.46) KMT2AMEN1LMNAGAAACACB
SCHEMBL4266248 0.69 ALDH1A3 (0.44) KMT2ALMNAACACBABL1
SCHEMBL15974757 0.68 GAA (0.64) KMT2AMEN1LMNAGAA
SCHEMBL27812746 0.68 ACACB (0.32) KMT2AACACBLRRK2ABL1
SCHEMBL1091816 0.67 MEN1 (0.42) KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2426113-B1 CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER KOWA CO (JP) 2013-11-06 EP disclosed
US-8551985-B2 Carbinol derivatives having heterocyclic linker KOWA COMPANY, LTD. (JP) 2013-10-08 US disclosed
US-8153634-B2 Carbinol derivatives having cyclic linker KOWA COMPANY, LTD. (JP) 2012-04-10 US disclosed
EP-2426113-A1 CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER Kowa Company, Ltd. (JP) 2012-03-07 EP disclosed
EP-2281817-A1 SUBSTITUTED CARBINOL COMPOUND HAVING CYCLIC LINKER Kowa Company, Ltd. (JP) 2011-02-09 EP disclosed
US-20100280013-A1 CARBINOL DERIVATIVES HAVING HETEROCYCLIC LINKER KOWA COMPANY, LTD. (JP) 2010-11-04 US disclosed
US-20100048610-A1 CARBINOL DERIVATIVES HAVING CYCLIC LINKER KOWA COMPANY, LTD. (JP) 2010-02-25 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 (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-20100280013-A1 CARBINOL DERIVATIVES HAVING HETEROCYCLIC LINKER NR1H2, NR1H3, CCR2 KMT2A 2327/4885MEN1 3479/4885LMNA 1575/4885
US-20100048610-A1 CARBINOL DERIVATIVES HAVING CYCLIC LINKER NR1H2, NR1H3, LDLR KMT2A 2383/4885MEN1 3823/4885LMNA 1288/4885

“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.