SCHEMBL20804372

SCHEMBL20804372

O=C(NCc1ccccc1)c1cc(NC(=O)c2ccccc2)cc(NC(=O)c2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.60
MEN1 O00255 1/20 0.60
HDAC6 Q9UBN7 3/20 0.59
HDAC2 Q92769 2/20 0.59
HDAC8 Q9BY41 2/20 0.59
NAMPT P43490 1/20 0.59
HDAC1 Q13547 1/20 0.58
PPARG P37231 3/20 0.58
LMNA P02545 2/20 0.57
MAPK1 P28482 1/20 0.57
KCNK3 O14649 1/20 0.57
KCNK9 Q9NPC2 1/20 0.57
HPGD P15428 2/20 0.56
FKBP5 Q13451 1/20 0.56
MAPT P10636 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
BCL2 P10415 1/20 0.56
MCL1 Q07820 1/20 0.56
TP53 P04637 1/20 0.55
SENP1 Q9P0U3 1/20 0.55

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
SCHEMBL27952268 0.89 LMNA (0.70) KMT2AHDAC6HDAC2HDAC8NAMPT
SCHEMBL457082 0.85 HDAC6 (0.79) HDAC6HDAC2HDAC8HDAC1LMNA
SCHEMBL5943989 0.85 HDAC6 (0.66) HDAC6HDAC2HDAC8NAMPTHDAC1
SCHEMBL5944048 0.84 NAMPT (0.53) HDAC6HDAC2HDAC8NAMPTHDAC1
SCHEMBL2915318 0.83 HDAC6 (0.74) KMT2AHDAC6HDAC2HDAC8HDAC1
SCHEMBL29184442 0.83 HDAC6 (0.76) HDAC6HDAC2HDAC8HDAC1LMNA
Hydrochloric Acid SCHEMBL3757721 0.83 HDAC6 (0.76) HDAC6HDAC2HDAC8HDAC1LMNA
SCHEMBL11900090 0.81 HDAC6 (0.85) HDAC6HDAC2HDAC8HDAC1LMNA
SCHEMBL22305399 0.81 KCNK3 (0.83) KMT2AMEN1KCNK3KCNK9FKBP5
SCHEMBL22047184 0.80 PPARG (0.78) KMT2AMEN1HDAC6HDAC2HDAC8

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-20230302030-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPase CENTRE HOSPITALIER DE L'UNIVERSITE DE MONTREAL (CA) 2023-09-28 US disclosed
US-20200246365-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE CENTRE HOSPITALIER DE L'UNIVERSITÉ DE MONTRÉAL (CA) 2020-08-06 US disclosed
WO-2019046931-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) 2019-03-14 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 (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-20200246365-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPASE RAN, RANBP1, GDI2 KMT2A 4807/4885MEN1 1886/4885HDAC6 79/4885
US-20230302030-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF AS INHIBITORS OF RAN GTPase RAN, RANBP1, GDI2 KMT2A 4807/4885MEN1 1886/4885HDAC6 79/4885

“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.