SCHEMBL7982744

SCHEMBL7982744

CC1(c2ccc(N)cc2)NC(=O)N(CC(=O)O)C1=O

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.64
L3MBTL1 Q9Y468 1/20 0.53
HTT P42858 1/20 0.52
POLB P06746 1/20 0.50
MEN1 O00255 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
SCHEMBL7982747 1.00 KMT2A (0.64) KMT2AL3MBTL1HTTPOLBMEN1
SCHEMBL7982748 1.00 KMT2A (0.64) KMT2AL3MBTL1HTTPOLBMEN1
SCHEMBL17622984 0.87 KMT2A (0.73) KMT2AHTTPOLBMEN1
SCHEMBL7031885 0.86 KMT2A (0.62) KMT2AL3MBTL1HTTMEN1
SCHEMBL8476428 0.86 KMT2A (0.62) KMT2AL3MBTL1HTTMEN1
SCHEMBL7034455 0.86 KMT2A (0.62) KMT2AL3MBTL1HTTMEN1
SCHEMBL8054430 0.86 KMT2A (0.64) KMT2AL3MBTL1HTTPOLBMEN1
SCHEMBL6270655 0.86 KMT2A (0.64) KMT2AL3MBTL1HTTPOLBMEN1
SCHEMBL6135511 0.86 KMT2A (0.64) KMT2AL3MBTL1HTTPOLBMEN1
Hydrochloric Acid SCHEMBL7970480 0.85 KMT2A (0.60) KMT2AL3MBTL1HTTMEN1

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-6191282-B1 DERIVATIVES OF 5-MEMBERED NITROGEN CONTAINING HETEROCYCLIC RING IS USED AS ANTICARCINOGENIC AGENT AND ANTICOAGULANT HOECHST MARION ROUSSEL (DE) 2001-02-20 US disclosed
US-5981492-A ADMINISTERED TO THE PATIENT TO INHIBIT THROMBOCYTE AGGREGATION, THE METASTASIZATION OF CARCINOMA CELLS, THE BINDING OF OSTEOCLASTS TO THE BONE SURFACE, OR FOR THE TREATMENT OF THROMBOSES HOECHST AKTIENGESELLSCHAFT (DE) 1999-11-09 US disclosed