SCHEMBL11545706

SCHEMBL11545706

CCOC(=O)c1nc2nc3cc(OC)c(OCc4ccccc4)cc3cc2c(=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 2/20 0.46
SRD5A2 P31213 2/20 0.46
PDGFRB P09619 2/20 0.45
PDGFRA P16234 2/20 0.45
SRC P12931 1/20 0.43
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
KMT2A Q03164 1/20 0.42
CTSV O60911 2/20 0.42
CTSL P07711 2/20 0.42
ELANE P08246 1/20 0.42
MMP13 P45452 2/20 0.42
PDE3B Q13370 2/20 0.41
PDE3A Q14432 2/20 0.41
MAPT P10636 1/20 0.41
EGFR P00533 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40

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
SCHEMBL11550906 1.00 SRD5A1 (0.46) SRD5A1SRD5A2PDGFRBPDGFRASRC
SCHEMBL11550171 0.89 SRC (0.50) PDGFRBPDGFRASRCPDE3BPDE3A
Pirolate SCHEMBL11546568 0.88 SRC (0.51) PDGFRBPDGFRASRCMEN1KMT2A
SCHEMBL11551727 0.84 MEN1 (0.61) SRD5A2MEN1HSP90AA1KMT2AMMP13
SCHEMBL11548520 0.81 SRC (0.43) PDGFRBPDGFRASRCMAPT
SCHEMBL11548055 0.81 SRC (0.43) PDGFRBPDGFRASRCMAPT
SCHEMBL11549725 0.80 SRC (0.43) PDGFRBPDGFRASRCMEN1KMT2A
SCHEMBL11623503 0.79 PDE3B (0.44) SRD5A1SRD5A2PDGFRBPDGFRAMEN1
SCHEMBL11550502 0.78 SRC (0.49) PDGFRBPDGFRASRCMEN1KMT2A
SCHEMBL11547661 0.78 RAB9A (0.46) MEN1KMT2APDE3BPDE3AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4134981-A ANTIALLERGENS PFIZER INC. (US) 1979-01-16 US disclosed
US-4120962-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1978-10-17 US disclosed
US-4044134-A FUSED WITH QUINOLINE OR PYRIDINE, 2-METHYL, ETHYL, OR ACETYL GROUP PFIZER INC. (US) 1977-08-23 US disclosed
US-3974161-A Fused pyrimidin-4(3H)-ones as antiallergy agents PFIZER INC. (US) 1976-08-10 US disclosed