SCHEMBL9618876

SCHEMBL9618876

CC(C)(C)OC(=O)CO/N=C/c1c[c]ccc1Cl

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
GPR55 Q9Y2T6 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL9618883 0.88
SCHEMBL9618812 0.86 ALDH1A1 (0.38) ALDH1A1MEN1KMT2A
SCHEMBL9618809 0.86 ALDH1A1 (0.38) ALDH1A1MEN1KMT2A
SCHEMBL9619097 0.84 L3MBTL1 (0.41) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL9619093 0.84 L3MBTL1 (0.41) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL9618856 0.82 ALDH1A1 (0.34) ALDH1A1MEN1KMT2A
SCHEMBL9618852 0.82 ALDH1A1 (0.34) ALDH1A1MEN1KMT2A
SCHEMBL9618928 0.80 L3MBTL1 (0.43) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL9618931 0.80 L3MBTL1 (0.43) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL9618903 0.78 ALDH1A1 (0.39) ALDH1A1

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
EP-0236916-B1 N-ARYLTETRAHYDROPHTHALIMIDE DERIVATIVES AND THEIR PRECURSORS BASF Aktiengesellschaft (DE) 1992-01-08 EP disclosed
US-4844733-A PRE- AND POSTEMERGENCE BASF AKTIENGESELLSCHAFT (DE) 1989-07-04 US disclosed
EP-0236916-A2 N-aryltetrahydrophthalimide derivatives and their precursors BASF Aktiengesellschaft (DE) 1987-09-16 EP disclosed