SCHEMBL23940377

SCHEMBL23940377

Cc1ccc(C2(c3ccc(C)cc3)c3cc(/C=C4\C(=O)c5ccccc5C4=C(C#N)C#N)sc3-c3sc(-c4cc(F)c(-c5cc6c(s5)-c5sc(/C=C7\C(=O)c8ccccc8C7=C(C#N)C#N)cc5C6(c5ccc(C)cc5)c5ccc(C)cc5)cc4F)cc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
PKM P14618 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL25791389 0.91 KDM4E (0.31) PKMALDH1A1MAPTHPGDNPSR1
SCHEMBL23515597 0.87 KMT2A (0.36) KMT2AMEN1PKMALDH1A1MAPT
SCHEMBL20042525 0.84 KMT2A (0.34) KMT2AMEN1PKMALDH1A1MAPT
SCHEMBL24759646 0.83
SCHEMBL21776017 0.83 KMT2A (0.34) KMT2AMEN1PKMALDH1A1MAPT
SCHEMBL24119923 0.82 KMT2A (0.31) KMT2AMEN1PKMALDH1A1MAPT
SCHEMBL21775988 0.82 KMT2A (0.31) KMT2AMEN1PKMALDH1A1MAPT
SCHEMBL23284293 0.81
SCHEMBL24637732 0.81 CSNK2A2 (0.32) KMT2AMEN1PKMALDH1A1MAPT
SCHEMBL20044526 0.80 PDE4A (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210323974-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC DEVICE INCLUDING SAME LG CHEM, LTD. (KR) 2021-10-21 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-20210323974-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC DEVICE INCLUDING SAME ODC1, AOX1, CYP1A1 KMT2A 468/4885MEN1 405/4885PKM 1815/4885

“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.