SCHEMBL3754497

SCHEMBL3754497

COC(=O)c1c(OC)ccc2nc(Nc3ccccc3)cnc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 6/20 0.56
PDGFRA P16234 6/20 0.56
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CASP3 P42574 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
BRAF P15056 1/20 0.43
MAPT P10636 2/20 0.41
ALOX15 P16050 1/20 0.41
RHOA P61586 1/20 0.41
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
MAPK1 P28482 1/20 0.40
PIK3CA P42336 1/20 0.40
HCRTR1 O43613 2/20 0.40
HCRTR2 O43614 2/20 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
SCHEMBL3758541 0.83 PDGFRB (0.59) PDGFRBPDGFRARAB9AMEN1ALDH1A1
SCHEMBL3521893 0.81 SMN1; SMN2 (0.52) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL3519633 0.79 MEN1 (0.47) NPC1RAB9AMEN1ALDH1A1KMT2A
SCHEMBL3521739 0.78 MEN1 (0.37) MEN1ALDH1A1KMT2ASMN1; SMN2MAPT
SCHEMBL3521388 0.77 TP53 (0.40) MEN1ALDH1A1KMT2AMAPT
SCHEMBL3520879 0.76 NPC1 (0.52) PDGFRBPDGFRANPC1RAB9AMEN1
SCHEMBL3518290 0.74 NPSR1 (0.49) MEN1ALDH1A1KMT2ASMN1; SMN2MAPK1
SCHEMBL3753086 0.73 SMN1; SMN2 (0.52) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL3909786 0.72 PDGFRB (1.00) PDGFRBPDGFRAALDH1A1SMN1; SMN2BRAF
SCHEMBL3758964 0.72 MEN1 (0.54) NPC1RAB9AMEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101983384-A Prolyl hydroxylase inhibitors SMITHKLINE BEECHAM CORP 2011-03-02 CN disclosed
US-20100305133-A1 Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2010-12-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100305133-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN3, EGLN2 PDGFRB 975/4885PDGFRA 639/4885NPC1 2674/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.