SCHEMBL7539248

SCHEMBL7539248

COC(=O)CCC(=O)c1c[nH]c2cc(C(=O)OC)ccc12

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.60
NR4A2 P43354 4/20 0.52
EIF2AK2 P19525 1/20 0.51
MAPT P10636 1/20 0.49
CTNNB1 P35222 3/20 0.47
WNT3A P56704 3/20 0.47
ASH1L Q9NR48 1/20 0.46
KIF11 P52732 1/20 0.46
CREBBP Q92793 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
GPR84 Q9NQS5 1/20 0.45
ADAM17 P78536 1/20 0.44
RAB9A P51151 1/20 0.44
PARP1 P09874 1/20 0.43
CDK2 P24941 1/20 0.43

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
SCHEMBL2807419 0.90 GPR84 (0.54) NPC1NR4A2MAPTCTNNB1WNT3A
SCHEMBL3243814 0.85 MAPT (0.67) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL7416222 0.85 NPC1 (0.64) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL10981308 0.84 NPC1 (0.56) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL10984173 0.84 NPC1 (0.56) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL10989463 0.84 NPC1 (0.56) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL10984972 0.84 NPC1 (0.56) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL10981435 0.84 NPC1 (0.56) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL10983460 0.84 NPC1 (0.56) NPC1NR4A2EIF2AK2MAPTASH1L
SCHEMBL10982974 0.84 NPC1 (0.56) NPC1NR4A2EIF2AK2MAPTASH1L

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820441-B1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO (JP) 2002-06-26 EP disclosed
US-6358992-B1 Method of inhibiting neoplastic cells with indole derivatives CELL PATHWAYS, INC. 2002-03-19 US disclosed
US-6069156-A Indole derivatives as cGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-30 US disclosed
CN-1187812-A Indole derivatives as CGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO (JP) 1998-07-15 CN disclosed
EP-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed