SCHEMBL5716754

SCHEMBL5716754

COc1ccc(C(=O)c2cc3cc(OC)cnc3[nH]2)c(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.50
PDGFRB P09619 2/20 0.49
PDGFRA P16234 2/20 0.49
RAB9A P51151 2/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MITF O75030 1/20 0.46
TP53 P04637 1/20 0.46
GAA P10253 1/20 0.46
FLT3 P36888 4/20 0.44
MEN1 O00255 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP2C19 P33261 1/20 0.44
CYP2C9 P11712 1/20 0.43
HDAC6 Q9UBN7 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
SCHEMBL5716786 0.88 ABL1 (0.51) PDGFRBPDGFRAFLT3MEN1CYP1A2
SCHEMBL5716760 0.84 DRD2 (0.50) NPC1PDGFRBPDGFRARAB9AKDM4E
SCHEMBL7066140 0.81 PDGFRB (0.76) PDGFRBPDGFRAFLT3MEN1CYP1A2
SCHEMBL5716713 0.79 PDGFRB (0.48) PDGFRBPDGFRAMEN1CYP1A2CYP3A4
SCHEMBL5716727 0.79 MEN1 (0.57) NPC1PDGFRBPDGFRARAB9ASMN1; SMN2
SCHEMBL5716694 0.79 PDGFRB (0.53) NPC1PDGFRBPDGFRAFLT3MEN1
SCHEMBL23170359 0.77 ABL1 (0.54)
SCHEMBL13180937 0.77 ALDH1A1 (0.43) PDGFRBPDGFRALMNAKDM4EMEN1
SCHEMBL15223892 0.77 ABL1 (0.45) PDGFRBPDGFRA
SCHEMBL29722116 0.77 ALDH1A1 (0.43) PDGFRBPDGFRALMNAKDM4EMEN1

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
EP-1276720-B1 2-ACYL INDOL DERIVATIVES AND THEIR USE AS ANTI-TUMOUR AGENTS BAXTER HEALTHCARE SA (CH) 2006-12-20 EP disclosed
US-20020091124-A1 2-acyl indole derivatives and their use as antitumor agents BECKERS THOMAS (DE) 2002-07-11 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-20020091124-A1 2-acyl indole derivatives and their use as antitumor agents IDO1, IDO2, INMT NPC1 3131/4885PDGFRB 3807/4885PDGFRA 3147/4885

“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.