SCHEMBL20535101

SCHEMBL20535101

Cc1ccc(S(=O)(=O)n2ccc(Br)c2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.47
LMNA P02545 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
POLB P06746 1/20 0.43
HPGD P15428 1/20 0.43
ALOX12 P18054 1/20 0.43
GFER P55789 1/20 0.43
EPHX2 P34913 6/20 0.43
MEP1B Q16820 1/20 0.38
KDM4E B2RXH2 1/20 0.38
F2 P00734 1/20 0.38
KMT2A Q03164 1/20 0.37

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
SCHEMBL18952140 0.85 NMT1 (0.36) RAPGEF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL29065515 0.81 RAPGEF4 (0.47) RAPGEF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL20535401 0.78 RAPGEF4 (0.44) RAPGEF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL15974991 0.77 CA1 (0.59) RAPGEF4GAAALDH1A1MAPTPOLB
SCHEMBL28726287 0.74 ALDH1A1 (0.42) RAPGEF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL20534977 0.73 RAPGEF4 (0.48) RAPGEF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL14529330 0.73 CD44 (0.34) RAPGEF4LMNAGAA
SCHEMBL18952089 0.73 RAPGEF4 (0.48) RAPGEF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL28510674 0.72 HTT (0.38) RAPGEF4LMNASMN1; SMN2GAAALDH1A1
SCHEMBL6581959 0.69 SMN1; SMN2 (0.79) LMNASMN1; SMN2GAAALDH1A1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114366748-A Crystalline solid forms of BET inhibitors 因赛特公司 2022-04-19 CN disclosed
CN-109715625-B Crystalline solid forms of BET inhibitors 因赛特公司 2022-04-19 CN disclosed
CN-114369091-A Crystalline solid forms of BET inhibitors 因赛特公司 2022-04-19 CN disclosed
EP-3609896-A1 BROMODOMAIN INHIBITORS AbbVie Inc. (US) 2020-02-19 EP disclosed
WO-2018188047-A1 BROMODOMAIN INHIBITORS ABBVIE INC. (US) 2018-10-18 WO disclosed