SCHEMBL7477929

SCHEMBL7477929

C[C@@H](c1ccccc1)N(Cc1ccccc1)C(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.51
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CTSS P25774 6/20 0.46
CTSL P07711 3/20 0.46
CTSB P07858 3/20 0.46
CTSK P43235 5/20 0.46
SYK P43405 1/20 0.44
SIGMAR1 Q99720 1/20 0.43
IDO1 P14902 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
SCHEMBL7477925 1.00 AKT1 (0.51) AKT1MEN1KMT2ACTSSCTSL
SCHEMBL7463209 0.84 KMT2A (0.55) MEN1KMT2A
SCHEMBL7463206 0.84 KMT2A (0.55) MEN1KMT2A
SCHEMBL23035079 0.84 AKT1 (0.50) AKT1MEN1KMT2ACTSSCTSL
SCHEMBL21563240 0.84 AKT1 (0.50) AKT1MEN1KMT2ACTSSCTSL
SCHEMBL23035088 0.84 AKT1 (0.50) AKT1MEN1KMT2ACTSSCTSL
SCHEMBL23035087 0.84 AKT1 (0.50) AKT1MEN1KMT2ACTSSCTSL
Hydrochloric Acid SCHEMBL7638810 0.83 KMT2A (0.54) MEN1KMT2A
Hydrochloric Acid SCHEMBL7705998 0.83 KMT2A (0.54) MEN1KMT2A
SCHEMBL17784913 0.82 AKT1 (0.48) AKT1MEN1KMT2ACTSSCTSL

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
EP-0871619-B1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMA (US) 2002-11-06 EP disclosed
US-6057451-A AMINOTHIAZOLE DERIVATIVES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2000-05-02 US disclosed