SCHEMBL23635357

SCHEMBL23635357

N#Cc1c(C2(c3ccc(Cl)cc3)CC2)nn2c(=O)c3c([nH]c12)CCCC3

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.40
▸ HSD11B1 P28845 6/20 0.36
▸ HPGD P15428 5/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ LMNA P02545 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ POLB P06746 2/20 0.35
▸ BLM P54132 2/20 0.35
▸ CTDSP1 Q9GZU7 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ CRHBP P24387 1/20 0.35
▸ CRHR2 Q13324 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ PDE9A O76083 1/20 0.34
▸ MAPK1 P28482 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HSD11B2 P80365 1/20 0.32
▸ NR1I2 O75469 1/20 0.32

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
SCHEMBL23635355 0.99 KDM5A (0.42) KDM5AALDH1A1HSD11B1HPGDMEN1
SCHEMBL23635387 0.98 KDM5A (0.40) KDM5AALDH1A1HSD11B1HPGDMEN1
SCHEMBL20565415 0.81 CA12 (0.38) ALDH1A1HPGDLMNAPLATKDM4E
SCHEMBL20565504 0.81 ADORA3 (0.37) ALDH1A1HPGDMEN1KMT2AMAPT
SCHEMBL23635367 0.79 HSD11B1 (0.35) ALDH1A1HSD11B1HPGDMEN1KMT2A
SCHEMBL20565460 0.78 MIF (0.36) L3MBTL1PLAT
SCHEMBL20564879 0.77 MAPT (0.36) ALDH1A1HPGDMEN1KMT2ALMNA
SCHEMBL20565117 0.77 FEN1 (0.36) HSD11B1MEN1KMT2APLAT
SCHEMBL23635332 0.76 L3MBTL1 (0.35) ALDH1A1HSD11B1HPGDMEN1KMT2A
SCHEMBL20565532 0.75 DDR1 (0.36) ALDH1A1HSD11B1HPGDMEN1KMT2A

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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