SCHEMBL3242636

SCHEMBL3242636

O=C(O)CNC(=O)c1ccc[nH]1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ POLB P06746 1/20 0.54
▸ TSHR P16473 1/20 0.53
▸ HDAC3 O15379 1/20 0.53
▸ HDAC4 P56524 1/20 0.53
▸ HDAC1 Q13547 1/20 0.53
▸ HDAC7 Q8WUI4 1/20 0.53
▸ HDAC2 Q92769 1/20 0.53
▸ HDAC10 Q969S8 1/20 0.53
▸ HDAC11 Q96DB2 1/20 0.53
▸ HDAC8 Q9BY41 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ HDAC9 Q9UKV0 1/20 0.53
▸ HDAC5 Q9UQL6 1/20 0.53
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49

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
SCHEMBL9039448 0.84 TSHR (0.61) KDM4ELMNAPOLBTSHRHDAC3
SCHEMBL1171646 0.84 KDM4E (0.54) KDM4ELMNAPOLBHDAC3HDAC4
SCHEMBL28928859 0.83 POLB (0.52) KDM4ELMNAPOLBTSHRHDAC3
SCHEMBL4591341 0.79 HDAC3 (0.58) KDM4ELMNAPOLBHDAC3HDAC4
SCHEMBL4443806 0.79 KDM4E (0.57) KDM4ELMNAPOLBTSHRHDAC3
SCHEMBL4591337 0.79 HDAC3 (0.58) KDM4ELMNAPOLBHDAC3HDAC4
SCHEMBL2781925 0.79 KDM4E (0.61) KDM4ELMNAPOLBHDAC3HDAC4
SCHEMBL2576103 0.79 KDM4E (0.74) KDM4ELMNAPOLBHDAC2HDAC8
SCHEMBL14088976 0.78 HDAC3 (0.74) KDM4ELMNATSHRHDAC3HDAC4
SCHEMBL4658952 0.78 KDM4E (0.59) KDM4ELMNAPOLBHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 — — WO claimed
WO-2025072741-A1 PRESERVATIVES FOR MOLECULAR SAMPLE ANALYSIS WITH SAMPLE COLLECTION DEVICES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-04-03 — — WO disclosed
WO-2022140565-A1 METHODS AND MATERIALS FOR ASSESSING RADIATION EXPOSURE NUTECH VENTURES (US) 2022-06-30 — — WO disclosed
WO-2010017418-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-11 — — WO disclosed
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