SCHEMBL21776013

SCHEMBL21776013

Cc1ccc(C2(c3ccc(C)cc3)c3c(F)c4c(c(F)c3-c3sc5cc(-c6ccc(C=C(C#N)C#N)c7nsnc67)sc5c32)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2c-4sc3cc(-c4ccc(C=C(C#N)C#N)c5nsnc45)sc23)cc1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
PABPC1 P11940 1/20 0.32
KMT2A Q03164 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
SCHEMBL20042532 0.92 MAPT (0.31) KDM4EMEN1MAPTPABPC1KMT2A
SCHEMBL21776019 0.88 ALDH1A1 (0.33) MEN1MAPTKMT2A
SCHEMBL20042481 0.87
SCHEMBL21776016 0.86 MAPT (0.31) KDM4EMEN1MAPTPABPC1KMT2A
SCHEMBL19917216 0.85
SCHEMBL20042533 0.84 KDM4E (0.32) KDM4EMEN1MAPTPABPC1KMT2A
SCHEMBL20040211 0.83
SCHEMBL19917211 0.81
SCHEMBL19917210 0.81
SCHEMBL18774744 0.81

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-20200066998-A1 ORGANIC SEMICONDUCTING COMPONDS MERCK PATENT GMBH (DE) 2020-02-27 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-20200066998-A1 ORGANIC SEMICONDUCTING COMPONDS EED, OCIAD2, OCIAD1 KDM4E 576/4885MEN1 1917/4885MAPT 36/4885

“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.