SCHEMBL4186899

SCHEMBL4186899

Nc1ccccc1NC(=O)c1ccc2c(c1)CCC2NC(=O)NCCc1c[nH]c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.56
PTGS2 P35354 1/20 0.51
MAPT P10636 6/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
LMNA P02545 1/20 0.49
CDK4 P11802 1/20 0.47
CCND1 P24385 1/20 0.47
ALDH1A1 P00352 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
GOT1 P17174 2/20 0.45
HDAC3 O15379 1/20 0.45
NCOR1 O75376 1/20 0.45
HDAC2 Q92769 1/20 0.45
NAMPT P43490 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL4192122 0.92 HDAC1 (0.47) HDAC1PTGS2MAPTMEN1KMT2A
SCHEMBL4183434 0.92 HDAC1 (0.47) HDAC1PTGS2MAPTMEN1KMT2A
SCHEMBL4178795 0.90 HDAC1 (0.55) HDAC1PTGS2MAPTMEN1KMT2A
SCHEMBL4185796 0.90 POLB (0.54) PTGS2MAPTMEN1KMT2AALDH1A1
SCHEMBL4192751 0.90 MEN1 (0.52) HDAC1MAPTMEN1KMT2ANPC1
SCHEMBL4186856 0.85 HDAC1 (0.44) HDAC1NPC1HDAC3HDAC2NAMPT
SCHEMBL4186103 0.84 HDAC4 (0.46) HDAC1MAPTMEN1KMT2ALMNA
SCHEMBL4188480 0.84 EPHX2 (0.42) HDAC1HDAC3HDAC2NAMPT
SCHEMBL4184370 0.84 HDAC1 (0.43) HDAC1MAPTHDAC3HDAC2
SCHEMBL4183442 0.84 EPHX2 (0.54) HDAC1NPC1RAB9AHDAC3HDAC2

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 HDAC1 579/4885PTGS2 648/4885MAPT 1308/4885

“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.