SCHEMBL5784672

SCHEMBL5784672

COc1cccc2c1OC1(CCCC1)C2

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.40
PDE4B Q07343 7/20 0.40
PDE4C Q08493 7/20 0.40
PDE4D Q08499 7/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HTR5A P47898 1/20 0.39
HTR1A P08908 1/20 0.38

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
SCHEMBL29914309 0.81 LMNA (0.35) LMNAKMT2ANPC1RAB9AHTR5A
SCHEMBL5723115 0.80 KDM4E (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL23304994 0.80 SIGMAR1 (0.39) LMNAKMT2ANPC1RAB9AHTR5A
SCHEMBL2378171 0.79 LMNA (0.60) LMNAKMT2ANPC1RAB9A
SCHEMBL5723473 0.79 KDM4E (0.47) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL19511131 0.77 FFAR4 (0.36) HTR1A
SCHEMBL11104349 0.76 ALDH1A1 (0.39) KMT2ANPC1RAB9AHTR5AHTR1A
SCHEMBL5786283 0.75 NPC1 (0.44) LMNAKMT2ANPC1RAB9A
SCHEMBL11107148 0.75 ALDH1A1 (0.41) KMT2ANPC1RAB9AHTR5AHTR1A
SCHEMBL129925 0.74 PDE4D (0.49) PDE4APDE4BPDE4CPDE4DLMNA

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
EP-1270577-B1 FUROISOQUINOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2006-12-06 EP disclosed
US-6924292-B2 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-02 US disclosed
US-20040092582-A1 Furoisoquinoline derivatives, process for producing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-05-13 US disclosed
EP-1270577-A1 FUROISOQUINOLINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-01-02 EP 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-20040092582-A1 Furoisoquinoline derivatives, process for producing the same and use thereof PDE3B, PDE5A, PDE3A PDE4A 6/4885PDE4B 4/4885PDE4C 7/4885

“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.