SCHEMBL12014659

SCHEMBL12014659

C1=CC2c3ccccc3-c3cc(-c4nc(-c5ccccc5)nc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)n4)ccc3C2C=C1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.33
HPGD P15428 3/20 0.33
KDM4E B2RXH2 2/20 0.32
ATM Q13315 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32
ESR1 P03372 2/20 0.31

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
SCHEMBL22505151 0.87 MEN1 (0.37) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21968644 0.86 EDNRB (0.37) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24061491 0.84 ESR1 (0.36) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22809184 0.83 EDNRB (0.35) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22665291 0.81 EDNRB (0.34) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL22223222 0.80 MEN1 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL24772137 0.78 MEN1 (0.38) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL23789847 0.78 EDNRB (0.34) ALDH1A1MAPTHPGDKDM4EATM
SCHEMBL13342068 0.76 L3MBTL1 (0.33) MEN1KMT2AATML3MBTL1TDP1
SCHEMBL24840760 0.75 PIM3 (0.30)

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-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

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 2768/4885ALDH1A1 261/4885

“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.