SCHEMBL1818741

SCHEMBL1818741

Cc1ccc(N(c2ccc(C)cc2)c2cc(-c3c4ccccc4c(Br)c4ccccc34)cc(N(c3ccc(C)cc3)c3ccc(C)cc3)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ACHE P22303 2/20 0.33
CTSV O60911 1/20 0.33
CTSL P07711 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
KIF11 P52732 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
PTPN1 P18031 1/20 0.31
GSK3B P49841 1/20 0.30
ADK P55263 1/20 0.30
MAPT P10636 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL3284458 0.90 ACHE (0.41) MEN1KMT2AACHECYP2C19ALDH1A1
SCHEMBL14195788 0.86 ACHE (0.33) ACHECYP2C19ALDH1A1TSHRPTPN1
SCHEMBL14211426 0.84 ACHE (0.40) MEN1KMT2AACHECTSVCTSL
SCHEMBL12005599 0.84 KMT2A (0.34) MEN1KMT2AACHECTSVCTSL
SCHEMBL12014767 0.83 CA2 (0.35) MEN1KMT2AACHECTSVCTSL
SCHEMBL1813318 0.82 ALOX5 (0.41) MEN1KMT2AACHECTSVCTSL
SCHEMBL14181758 0.81 ACHE (0.45) MEN1KMT2AACHECTSVCTSL
SCHEMBL1262728 0.81 ACHE (0.47) MEN1KMT2AACHECYP2C19ALDH1A1
SCHEMBL1505829 0.79 ACHE (0.49) MEN1KMT2AACHEALDH1A1TSHR
SCHEMBL14181736 0.78 ACHE (0.42) MEN1KMT2AACHECTSVCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120217449-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-08-30 US disclosed
US-20120217449-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-08-30 US disclosed
US-20120217449-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2012-08-30 US disclosed
WO-2011054442-A2 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-05-12 WO disclosed
WO-2011054442-A2 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-05-12 WO 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-20120217449-A1 MATERIALS FOR ELECTRONIC DEVICES EFNA1, DDT, ERCC1 MEN1 171/4885KMT2A 2768/4885ACHE 518/4885

“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.