SCHEMBL19576907

SCHEMBL19576907

C/N=C/C(=C\NCCO)c1ccc(NC(=O)Cc2ccc(F)cc2Cl)cc1S(=O)(=O)NC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GSTO1 P78417 3/20 0.42
▸ P2RX4 Q99571 5/20 0.40
▸ ROCK2 O75116 1/20 0.36
▸ ACKR3 P25106 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ KCNJ6 P48051 1/20 0.35
▸ KCNJ5 P48544 1/20 0.35
▸ KCNJ3 P48549 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ HPGD P15428 1/20 0.34
▸ APOBEC3G Q9HC16 1/20 0.34
▸ ANO1 Q5XXA6 1/20 0.34
▸ P2RX7 Q99572 1/20 0.33

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
SCHEMBL22894329 0.75 GSTO1 (0.52) GSTO1P2RX4ROCK2ACKR3ALDH1A1
SCHEMBL19576777 0.67 P2RX4 (0.61) P2RX4ROCK2
SCHEMBL20929060 0.66 P2RX4 (0.51) GSTO1P2RX4ROCK2ACKR3ALDH1A1
SCHEMBL19551715 0.65 P2RX4 (0.47) GSTO1P2RX4ROCK2ACKR3ALDH1A1
SCHEMBL19551717 0.65 P2RX4 (0.47) GSTO1P2RX4ROCK2ACKR3ALDH1A1
SCHEMBL24686679 0.64 RECQL (0.47) P2RX4ROCK2ACKR3ALDH1A1LMNA
SCHEMBL24687088 0.64 ROCK2 (0.49) P2RX4ROCK2ACKR3ALDH1A1LMNA
SCHEMBL30403105 0.63 ANO1 (0.49) P2RX4ROCK2ANO1
SCHEMBL19576873 0.63 KCNJ5 (0.60) GSTO1P2RX4ALDH1A1LMNAPOLB
SCHEMBL12824945 0.62 MEN1 (0.54) P2RX4ROCK2ACKR3ALDH1A1LMNA

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
EP-3458443-B1 AROMATIC SULFONAMIDE DERIVATIVES Bayer Pharma AG (DE) 2020-08-19 — — EP disclosed
WO-2017191000-A1 AROMATIC SULFONAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-11-09 — — WO disclosed
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