SCHEMBL27677755

SCHEMBL27677755

COc1ccc(N(C(=O)c2ccccc2Cl)c2nc3ccc(NC(=O)Cc4ccccc4)cc3s2)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.53
POLB P06746 1/20 0.51
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 4/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
TP53 P04637 2/20 0.44
KDR P35968 2/20 0.44
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
THRB P10828 1/20 0.43
KDM4E B2RXH2 1/20 0.42
RAB9A P51151 1/20 0.42
CSNK1D P48730 1/20 0.42

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
SCHEMBL5016992 0.93 LMNA (0.51) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL5016959 0.86 HDAC1 (0.40) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL5017068 0.86 PTGS2 (0.49) LMNAPOLBMAPTSMN1; SMN2TP53
SCHEMBL5016928 0.84 HSD17B10 (0.42) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL5023079 0.83 ALDH1A1 (0.44) LMNAMEN1KMT2AALDH1A1MAPT
SCHEMBL14365374 0.83 GHSR (0.41) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL5022953 0.82 KDM4E (0.53) LMNAPOLBMEN1KMT2AALDH1A1
SCHEMBL5016984 0.82 MAPT (0.43) LMNAPOLBMEN1KMT2AMAPT
SCHEMBL5023503 0.81 GHSR (0.38) LMNAPOLBMAPTSMN1; SMN2KDM4E
SCHEMBL5016958 0.80 MEN1 (0.44) LMNAPOLBMEN1KMT2AALDH1A1

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
CN-100368407-C 2-aminobenzothiazoles as CB1 receptor inverse agonists HOFFMANN LA ROCHE (CH) 2008-02-13 CN claimed
CN-100368407-C 2-aminobenzothiazoles as CB1 receptor inverse agonists HOFFMANN LA ROCHE (CH) 2008-02-13 CN disclosed