SCHEMBL20525403

SCHEMBL20525403

CC(NC(=O)c1ccc2c(c1)N(C)C(=O)c1ccccc1S2)c1ccc(Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.62
TP53 P04637 9/20 0.56
MAPT P10636 8/20 0.56
POLB P06746 3/20 0.56
PABPC1 P11940 1/20 0.54
APOBEC3A P31941 1/20 0.54
EIF4H Q15056 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
THRB P10828 1/20 0.51

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
SCHEMBL20525442 1.00 LMNA (0.62) LMNATP53MAPTPOLBPABPC1
SCHEMBL20525402 1.00 LMNA (0.62) LMNATP53MAPTPOLBPABPC1
SCHEMBL20525374 0.92 LMNA (0.67) LMNATP53MAPTPOLBPABPC1
SCHEMBL20525375 0.92 LMNA (0.67) LMNATP53MAPTPOLBPABPC1
SCHEMBL20525437 0.92 LMNA (0.67) LMNATP53MAPTPOLBPABPC1
SCHEMBL20525444 0.81 POLB (0.74) LMNATP53MAPTPOLBPABPC1
SCHEMBL16431347 0.79 DRD2 (0.68) LMNATP53MAPTPOLBPABPC1
SCHEMBL17837255 0.79 THRB (0.50) TP53MAPTPOLBTHRB
SCHEMBL17837230 0.79 THRB (0.50) TP53MAPTPOLBTHRB
SCHEMBL17837257 0.79 THRB (0.50) TP53MAPTPOLBTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3027612-B1 11-OXO-10,11-DIHYDRODIBENZO[B,F][1,4]THIAZEPINE S-OXIDE DERIVATIVES AND THEIR USE AS DOPAMINE D2 RECEPTOR ANTAGONISTS US HEALTH (US) 2018-10-10 EP claimed