SCHEMBL6837653

SCHEMBL6837653

COC(=O)c1ccc(OC)c2oc(C(=O)c3ccccc3)cc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.60
RAB9A P51151 3/20 0.60
NPC1 O15118 2/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
PDE4A P27815 10/20 0.53
PDE4B Q07343 10/20 0.53
PDE4C Q08493 10/20 0.53
PDE4D Q08499 10/20 0.53
MAPT P10636 3/20 0.48
HTT P42858 2/20 0.48
ALDH1A1 P00352 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 2/20 0.47
HSD17B10 Q99714 2/20 0.47
ALOX15 P16050 1/20 0.47
PKM P14618 1/20 0.45
SLC6A3 Q01959 1/20 0.45
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL6839328 0.90 SMN1; SMN2 (0.62) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL5659664 0.85 KMT2A (0.54) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL5723004 0.84 RAB9A (0.56) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL6942657 0.81 PDE4A (0.71) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL6836702 0.81 PDE4A (0.56) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL7051399 0.80 PDE4A (0.55) SMN1; SMN2RAB9ANPC1PDE4APDE4B
SCHEMBL6837725 0.80 RAB9A (0.60) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL5722911 0.80 PDE4D (0.56) SMN1; SMN2RAB9ANPC1MEN1KMT2A
SCHEMBL5723686 0.80 ALDH1A1 (0.53) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL5659646 0.79 SMN1; SMN2 (0.47) SMN1; SMN2RAB9ANPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6716987-B1 PHOSPHODIESTERASE IV INHIBITORS KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-04-06 US disclosed
US-6514996-B2 Derivatives of benzofuran or benzodioxole KYOWA HAKKO KOGYO CO., LTD. (JP) 2003-02-04 US disclosed
US-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-09-12 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-20020128290-A1 DERIVATIVES OF BENZOFURAN OR BENZODIOXOLE CBR1, CBR3, CYC1 SMN1; SMN2 1477/4885RAB9A 2778/4885NPC1 956/4885

“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.