SCHEMBL6838015

SCHEMBL6838015

COc1ccc(C=O)c2cc(C(=O)NCCc3ccccc3)oc12

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.54
RAB9A P51151 5/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
TAAR1 Q96RJ0 1/20 0.51
MAPT P10636 8/20 0.51
LMNA P02545 2/20 0.51
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
NAMPT P43490 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
THRB P10828 1/20 0.49
POLB P06746 1/20 0.47
ABCB1 P08183 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.46

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
SCHEMBL6838023 0.94 ALDH1A1 (0.48) NPC1RAB9AMEN1KMT2ATAAR1
SCHEMBL6837883 0.89 SMN1; SMN2 (0.52) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL6837885 0.84 NPC1 (0.53) NPC1RAB9AMEN1KMT2ATAAR1
SCHEMBL6837902 0.83 NPC1 (0.52) NPC1RAB9AMEN1KMT2ATAAR1
SCHEMBL6833303 0.82 NPC1 (0.51) NPC1RAB9AMEN1KMT2ATAAR1
SCHEMBL6836531 0.82 MAPT (0.52) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL6836758 0.82 NPC1 (0.53) NPC1RAB9AMEN1KMT2ATAAR1
SCHEMBL6836625 0.82 NPC1 (0.50) NPC1RAB9AMEN1KMT2ATAAR1
SCHEMBL6837778 0.82 SMN1; SMN2 (0.52) NPC1RAB9AMEN1KMT2ATAAR1
SCHEMBL6836449 0.80 NPC1 (0.48) NPC1RAB9AMEN1KMT2ATAAR1

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 NPC1 956/4885RAB9A 2778/4885MEN1 4379/4885

“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.