SCHEMBL29961069

SCHEMBL29961069

CNC(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.69
MEN1 O00255 7/20 0.67
KMT2A Q03164 7/20 0.67
POLB P06746 4/20 0.65
KCNMA1 Q12791 1/20 0.63
ALDH1A1 P00352 3/20 0.62
PKM P14618 2/20 0.60
CRHBP P24387 1/20 0.60
CRHR2 Q13324 1/20 0.60
LMNA P02545 2/20 0.59
MAPK1 P28482 2/20 0.59
HTT P42858 2/20 0.59
BLM P54132 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.58

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
SCHEMBL9332891 0.89 MAPT (0.67) MAPTMEN1KMT2APOLBKCNMA1
SCHEMBL13561219 0.88 MEN1 (0.76) MAPTMEN1KMT2APOLBKCNMA1
SCHEMBL7304335 0.88 HTT (0.72) MAPTMEN1KMT2APOLBKCNMA1
SCHEMBL2033537 0.85 MEN1 (0.74) MAPTMEN1KMT2APOLBKCNMA1
SCHEMBL4254980 0.85 TP53 (0.75) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL29961312 0.83 HTT (0.82) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL14288427 0.82 MEN1 (0.68) MAPTMEN1KMT2APOLBKCNMA1
SCHEMBL12359723 0.81 HTT (0.78) MAPTMEN1KMT2APOLBKCNMA1
SCHEMBL2502044 0.81 HTT (0.76) MAPTMEN1KMT2APOLBKCNMA1
SCHEMBL8174145 0.80 MEN1 (0.62) MAPTMEN1KMT2APOLBKCNMA1

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-20240158355-A1 BET SUBFAMILY INHIBITORS AND METHODS USING SAME BAYLOR COLLEGE MEDICINE (US) 2024-05-16 US disclosed
WO-2022159454-A1 BET SUBFAMILY INHIBITORS AND METHODS USING SAME BAYLOR COLLEGE OF MEDICINE (US) 2022-07-28 WO 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-20240158355-A1 BET SUBFAMILY INHIBITORS AND METHODS USING SAME BRDT, BRD3, BRD2 MAPT 2774/4885MEN1 1436/4885KMT2A 122/4885

“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.