SCHEMBL25596734

SCHEMBL25596734

Bc1ccc2cc[nH]c2c1S(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.42
▸ PGR P06401 1/20 0.42
▸ NR3C2 P08235 1/20 0.42
▸ AR P10275 1/20 0.42
▸ BRD4 O60885 1/20 0.36
▸ TAF1 P21675 1/20 0.36
▸ BRPF1 P55201 1/20 0.36
▸ CREBBP Q92793 1/20 0.36
▸ CECR2 Q9BXF3 1/20 0.36
▸ BRD9 Q9H8M2 1/20 0.36
▸ TNF P01375 1/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ KEAP1 Q14145 1/20 0.33
▸ AHR P35869 1/20 0.32
▸ PDPK1 O15530 1/20 0.32
▸ BCHE P06276 2/20 0.31
▸ PTPRC P08575 1/20 0.30
▸ PTPN2 P17706 1/20 0.30
▸ PTPN1 P18031 1/20 0.30
▸ PTPRB P23467 1/20 0.30

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
SCHEMBL25596762 0.79 NR3C1 (0.42) NR3C1PGRNR3C2ARBRD4
SCHEMBL30968937 0.79 AHR (0.44) NR3C1PGRNR3C2ARBRD4
SCHEMBL30456277 0.75 KEAP1 (0.51) NR3C1PGRNR3C2ARBRD4
SCHEMBL25596753 0.75 NR3C1 (0.40) NR3C1PGRNR3C2ARBRD4
SCHEMBL25363572 0.71 NR3C1 (0.40) NR3C1PGRNR3C2ARKEAP1
SCHEMBL31122401 0.71 NR3C1 (0.40) NR3C1PGRNR3C2ARKEAP1
SCHEMBL593678 0.67 NR3C1 (0.62) NR3C1PGRNR3C2ARBRD4
SCHEMBL1374474 0.66 TNF (0.54) NR3C1PGRNR3C2ARBRD4
SCHEMBL29591462 0.66 TNF (0.54) NR3C1PGRNR3C2ARBRD4
SCHEMBL10179358 0.63 NR3C1 (0.41) NR3C1PGRNR3C2ARBRD4

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-3484871-B1 PIPERIDINE DERIVATIVES AS INHIBITORS OF CYCLIN DEPENDENT KINASE 7 (CDK7) SYROS PHARMACEUTICALS INC (US) 2023-06-07 — — EP disclosed
Send feedback