SCHEMBL6038138

SCHEMBL6038138

O=C(COCc1ccc(F)cc1)NCCCCCc1csc(NC(=O)Nc2ccc(F)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
DDR2 Q16832 2/20 0.45
MAPK14 Q16539 2/20 0.45
ROCK1 Q13464 1/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 3/20 0.41
TP53 P04637 2/20 0.41
POLB P06746 2/20 0.40
RAB9A P51151 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NPC1 O15118 1/20 0.39

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
SCHEMBL6038109 0.96 DDR2 (0.51) MAPTDDR2MAPK14ROCK1KMT2A
SCHEMBL6037944 0.96 LMNA (0.48) MAPTDDR2MAPK14KMT2ALMNA
SCHEMBL6037891 0.90 KMT2A (0.45) MAPTDDR2MAPK14ROCK1KMT2A
SCHEMBL6037978 0.89 LMNA (0.47) MAPTDDR2MAPK14ROCK1KMT2A
SCHEMBL5282375 0.89 AOC3 (0.47) DDR2MAPK14KMT2ALMNATP53
SCHEMBL6038114 0.89 MAPT (0.52) MAPTDDR2MAPK14KMT2ALMNA
SCHEMBL5279990 0.88 ROCK2 (0.46) DDR2MAPK14ROCK1KMT2ALMNA
SCHEMBL5278096 0.87 SMN1; SMN2 (0.43) MAPTDDR2MAPK14KMT2ALMNA
SCHEMBL6038350 0.86 DDR2 (0.42) DDR2MAPK14ROCK1LMNARAB9A
SCHEMBL6037921 0.86 DDR2 (0.44) MAPTDDR2MAPK14KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US claimed
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 MAPT 3848/4885DDR2 3735/4885MAPK14 3936/4885

“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.