SCHEMBL4186103

SCHEMBL4186103

Cc1[nH]c2ccccc2c1CCNC(=O)NC1CCc2cc(C(=O)Nc3ccccc3N)ccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.46
EP300 Q09472 1/20 0.46
MEF2D Q14814 1/20 0.46
PABPC1 P11940 1/20 0.46
ALOX15 P16050 1/20 0.46
ATM Q13315 1/20 0.46
TRPV1 Q8NER1 7/20 0.44
LMNA P02545 2/20 0.42
POLB P06746 1/20 0.42
HDAC1 Q13547 6/20 0.42
HDAC3 O15379 5/20 0.42
MAPT P10636 3/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HDAC2 Q92769 3/20 0.40
MEN1 O00255 1/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL4186899 0.84 HDAC1 (0.56) LMNAHDAC1HDAC3MAPTL3MBTL1
SCHEMBL4184419 0.83 EPHX2 (0.46) HDAC4TRPV1HDAC1HDAC3HDAC2
SCHEMBL4184370 0.83 HDAC1 (0.43) HDAC4TRPV1HDAC1HDAC3MAPT
SCHEMBL4183442 0.83 EPHX2 (0.54) HDAC4HDAC1HDAC3HDAC2HDAC7
SCHEMBL13653266 0.82 EPHX2 (0.46) HDAC4TRPV1LMNAHDAC1HDAC3
SCHEMBL4183434 0.81 HDAC1 (0.47) ATMTRPV1LMNAPOLBHDAC1
SCHEMBL4186856 0.81 HDAC1 (0.44) HDAC4TRPV1HDAC1HDAC3HDAC2
SCHEMBL4188365 0.80 TRPV1 (0.48) TRPV1HDAC1HDAC3HDAC2HDAC8
SCHEMBL4188480 0.80 EPHX2 (0.42) HDAC4TRPV1HDAC1HDAC3HDAC2
SCHEMBL13653281 0.80 HDAC1 (0.48) HDAC4TRPV1HDAC1HDAC3HDAC2

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 HDAC4 962/4885EP300 310/4885MEF2D 1922/4885

“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.