SCHEMBL23635369

SCHEMBL23635369

N#Cc1c(C2(c3ccc(Cl)cc3)CC2)nn2c(=O)c(Oc3ccc(Br)cc3)c[nH]c12

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 3/20 0.35
▸ HSD11B1 P28845 3/20 0.35
▸ MMP2 P08253 2/20 0.31
▸ MMP9 P14780 2/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL23635327 0.95 HSD11B1 (0.37) NR1I2HSD11B1MAPK1L3MBTL1
SCHEMBL23635283 0.92 HSD11B1 (0.37) NR1I2HSD11B1MMP2MMP9MAPK1
SCHEMBL23635370 0.89 HSD11B1 (0.33) NR1I2HSD11B1MAPK1L3MBTL1
SCHEMBL23635328 0.89 HSD11B1 (0.34) NR1I2HSD11B1MAPK1L3MBTL1
SCHEMBL23635346 0.87 HSD11B1 (0.43) NR1I2HSD11B1MAPK1
SCHEMBL23635365 0.86 NR1I2 (0.39) NR1I2HSD11B1MAPK1
SCHEMBL23635284 0.85 HSD11B1 (0.34) NR1I2HSD11B1MAPK1L3MBTL1
SCHEMBL23635331 0.85 HSD11B1 (0.42) NR1I2HSD11B1
SCHEMBL23635367 0.81 HSD11B1 (0.35) NR1I2HSD11B1MAPK1L3MBTL1
SCHEMBL23635332 0.79 L3MBTL1 (0.35) HSD11B1L3MBTL1

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-2021142420-A1 PYRAZOLO[1,5-a]PYRIMIDIN-7(4H)-ONE INHIBITORS OF DYNEIN KAPOOR TARUN M (US) 2021-07-15 — — WO disclosed
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