SCHEMBL29790744

SCHEMBL29790744

O=C(NO)c1ccc2c(c1)N(Cc1cc(Cl)cc(Cl)c1)C(=O)CO2

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
MEN1 O00255 1/20 0.52
LMNA P02545 1/20 0.52
KMT2A Q03164 1/20 0.52
HDAC1 Q13547 5/20 0.51
HDAC6 Q9UBN7 5/20 0.51
HDAC8 Q9BY41 4/20 0.51
KMO O15229 1/20 0.48
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
USP2 O75604 1/20 0.45
HTT P42858 1/20 0.45
HDAC2 Q92769 1/20 0.45
TSHR P16473 1/20 0.45
CPT1A P50416 1/20 0.44
CPT1B Q92523 1/20 0.44
ALOX15 P16050 2/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL18581120 1.00 MAPT (0.52) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL18581490 0.93 KDM4E (0.52) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL29790747 0.93 KDM4E (0.52) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL18581009 0.92 HDAC1 (0.57) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL18581261 0.90 MAPT (0.54) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL29790799 0.90 MAPT (0.54) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL29790715 0.90 MAPT (0.46) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL18581206 0.90 MAPT (0.46) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL18581373 0.89 ALDH1A1 (0.58) MAPTMEN1LMNAKMT2AHDAC1
SCHEMBL23356530 0.88 MAPT (0.52) MAPTMEN1LMNAKMT2AHDAC1

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-20230406830-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS Valo Health, LLC 2023-12-21 US disclosed
US-11414392-B2 [6,6] fused bicyclic HDAC8 inhibitors VALO HEALTH, INC. (US) 2022-08-16 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 (2 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-20230406830-A1 [6,6] FUSED BICYCLIC HDAC8 INHIBITORS HDAC8, HDAC3, HDAC2 MAPT 135/4885MEN1 3243/4885LMNA 558/4885
US-11414392-B2 [6,6] fused bicyclic HDAC8 inhibitors HDAC8, HDAC3, HDAC2 MAPT 135/4885MEN1 3243/4885LMNA 558/4885

“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.