SCHEMBL8561203

SCHEMBL8561203

CCOc1ccc2c(Nc3ccc(OC)cc3)c(C(=O)O)cnc2n1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PDE4B Q07343 2/20 0.48
MAPT P10636 2/20 0.46
CSF1R P07333 3/20 0.45
NPSR1 Q6W5P4 2/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
PDE4D Q08499 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
CHEK1 O14757 1/20 0.41
NTRK2 Q16620 1/20 0.41
PAX8 Q06710 1/20 0.41

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
SCHEMBL8561277 0.90 PDE4B (0.61) GAASMN1; SMN2PDE4BMAPTNPSR1
Hydrochloric Acid SCHEMBL8563873 0.89 PDE4B (0.60) GAASMN1; SMN2PDE4BMAPTNPSR1
SCHEMBL8326516 0.88 MEN1 (0.46) GAASMN1; SMN2MAPTALDH1A1PAX8
SCHEMBL8330781 0.85 GAA (0.47) GAASMN1; SMN2PDE4BMAPTCSF1R
SCHEMBL8329323 0.83 GAA (0.47) GAASMN1; SMN2PDE4BMAPTCSF1R
SCHEMBL8564146 0.82 CSF1R (0.50) GAASMN1; SMN2PDE4BMAPTCSF1R
SCHEMBL8566689 0.82 PDE4B (0.43) GAASMN1; SMN2PDE4BMAPTCSF1R
SCHEMBL8565887 0.77 GAA (0.50) GAASMN1; SMN2PDE4BCSF1RNPSR1
SCHEMBL8329045 0.77 MAPT (0.53) GAASMN1; SMN2PDE4BMAPTNPSR1
SCHEMBL8326664 0.77 CSF1R (0.48) GAASMN1; SMN2PDE4BMAPTCSF1R

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-0618916-B1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES KNOLL AG (DE) 1998-09-23 EP claimed