SCHEMBL21886080

SCHEMBL21886080

CC(C)NS(=O)(=O)Cc1cccc(F)c1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.44
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
BRD4 O60885 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PARP14 Q460N5 1/20 0.43
ADAMTS4 O75173 1/20 0.42
MMP13 P45452 1/20 0.42
MAOB P27338 2/20 0.40
MAOA P21397 1/20 0.40
SCN9A Q15858 1/20 0.40

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
SCHEMBL25541056 0.86 ALDH1A1 (0.47) TAAR1ALDH1A1HTTKMT2AMEN1
SCHEMBL16000106 0.82 ACLY (0.46) TAAR1ALDH1A1HTTKMT2AMEN1
SCHEMBL5460648 0.81 TAAR1 (0.51) TAAR1KMT2AMEN1BRD4PARP14
SCHEMBL4433007 0.81 MEN1 (0.43) ALDH1A1HTTKMT2AMEN1LMNA
SCHEMBL4637575 0.81 ALDH1A1 (0.43) ALDH1A1HTTKMT2AMEN1ADAMTS4
SCHEMBL16000102 0.81 CNR1 (0.53) TAAR1ALDH1A1HTTKMT2AMEN1
SCHEMBL18571230 0.80 HTR2A (0.53) TAAR1LMNAMAPTADAMTS4MMP13
SCHEMBL21885821 0.80 BRD4 (0.47) TAAR1KMT2ABRD4PARP14
SCHEMBL13234055 0.80 KMT2A (0.49) TAAR1ALDH1A1HTTKMT2AMEN1
SCHEMBL1998707 0.79 ALDH1A1 (0.63) ALDH1A1HTTKMT2AMEN1MMP13

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
WO-2020073011-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY ANNAPURNA BIO, INC. (US) 2020-04-09 WO disclosed