SCHEMBL4184419

SCHEMBL4184419

Cc1ccc(CCNC(=O)NC2CCc3cc(C(=O)Nc4ccccc4N)ccc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.46
TRPV1 Q8NER1 3/20 0.44
HDAC1 Q13547 11/20 0.43
HDAC2 Q92769 6/20 0.43
HDAC3 O15379 6/20 0.43
HDAC4 P56524 2/20 0.43
HDAC7 Q8WUI4 2/20 0.43
HDAC10 Q969S8 2/20 0.43
HDAC11 Q96DB2 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
HDAC9 Q9UKV0 2/20 0.43
HDAC5 Q9UQL6 2/20 0.43
NCOR1 O75376 1/20 0.43
DHODH Q02127 1/20 0.42

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
SCHEMBL4183442 0.93 EPHX2 (0.54) EPHX2HDAC1HDAC2HDAC3HDAC4
SCHEMBL13653266 0.92 EPHX2 (0.46) EPHX2TRPV1HDAC1HDAC2HDAC3
SCHEMBL4188365 0.91 TRPV1 (0.48) EPHX2TRPV1HDAC1HDAC2HDAC3
SCHEMBL13653281 0.91 HDAC1 (0.48) EPHX2TRPV1HDAC1HDAC2HDAC3
SCHEMBL4197918 0.91 HDAC2 (0.49) TRPV1HDAC1HDAC2HDAC3HDAC4
SCHEMBL4195363 0.91 HDAC1 (0.52) EPHX2TRPV1HDAC1HDAC2HDAC3
SCHEMBL4184370 0.88 HDAC1 (0.43) EPHX2TRPV1HDAC1HDAC2HDAC3
SCHEMBL4178941 0.87 HDAC1 (0.49) EPHX2TRPV1HDAC1HDAC2HDAC3
SCHEMBL4197887 0.87 HDAC1 (0.49) EPHX2TRPV1HDAC1HDAC2HDAC3
SCHEMBL13653271 0.87 ABCB1 (0.47) EPHX2TRPV1HDAC1HDAC2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247590-A1 Indane amides BAYER PHARMACEUTICLAS CORPORATION (US) 2009-10-01 US disclosed
US-20090247590-A1 Indane amides BAYER PHARMACEUTICLAS CORPORATION (US) 2009-10-01 US disclosed
US-20090247590-A1 Indane amides BAYER PHARMACEUTICLAS CORPORATION (US) 2009-10-01 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-20090247590-A1 Indane amides MKI67, PPIP5K2, CCNA1 EPHX2 3172/4885TRPV1 2361/4885HDAC1 579/4885

“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.