SCHEMBL7290389

SCHEMBL7290389

CC(C)(C)OC(=O)NCc1ccc(-c2n[nH]c(=O)o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 13/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ ATR Q13535 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ CTSD P07339 1/20 0.43

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
SCHEMBL29363056 0.86 NOTUM (0.51) NOTUMCYP1A2
SCHEMBL29366281 0.80 BRD4 (0.49) NOTUMCYP1A2CTSD
SCHEMBL28622786 0.80 NOTUM (0.46) NOTUML3MBTL1CYP1A2KDM4ELMNA
SCHEMBL28614218 0.80 NOTUM (0.46) NOTUMCYP1A2CTSD
SCHEMBL30615060 0.78 ATR (0.53) L3MBTL1ATR
SCHEMBL3180689 0.77 L3MBTL1 (0.61) L3MBTL1
SCHEMBL524005 0.77 NPSR1 (0.54) L3MBTL1CYP1A2KDM4ELMNA
SCHEMBL1272211 0.76 HDAC1 (0.48) L3MBTL1CYP1A2
SCHEMBL15110089 0.76 HPN (0.48) L3MBTL1
SCHEMBL24000187 0.75 ROCK2 (0.63) CYP1A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5981531-A FOR INHIBITING PLATELET AGGREGATION ZENECA LIMITED (GB) 1999-11-09 — — US disclosed
US-5760057-A ANTICOAGULANTS ZENECA LIMITED (GB) 1998-06-02 — — US disclosed
EP-0632016-B1 1,2-Diacylated hydrazine derivatives and their use as cell adhesion inhibitors ZENECA LTD (GB) 1997-04-09 — — EP disclosed
US-5612373-A ANTICOAGULANTS ZENECA LIMITED (GB) 1997-03-18 — — US disclosed
WO-1995000472-A1 1,2 DIACYLATED HYDRAZINE DERIVATIVES AND THEIR USE AS ALL ADHESION INHIBITORS ZENECA LIMITED (GB) 1995-01-05 — — WO disclosed
EP-0632016-A1 1,2-Diacylated hydrazine derivatives and their use as cell adhesion inhibitors ZENECA LIMITED (GB) 1995-01-04 — — EP disclosed
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