SCHEMBL6837565

SCHEMBL6837565

COc1ccc(NC(=O)c2cc3c(CN[C@@H](C)c4ccccc4)ccc(OC)c3o2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.46
TP53 P04637 2/20 0.46
SMN1; SMN2 Q16637 5/20 0.46
TSHR P16473 2/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
MAPK1 P28482 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
HTT P42858 2/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 5/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KDM4E B2RXH2 3/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL6839343 0.94 LMNA (0.47) MAPTTP53SMN1; SMN2TSHRRAB9A
SCHEMBL6839345 0.94 LMNA (0.47) MAPTTP53SMN1; SMN2TSHRRAB9A
SCHEMBL6837917 0.92 KMT2A (0.46) MAPTTP53SMN1; SMN2RAB9ALMNA
SCHEMBL6837915 0.92 KMT2A (0.46) MAPTTP53SMN1; SMN2RAB9ALMNA
SCHEMBL6837813 0.90 NR1H4 (0.43) MAPTTP53SMN1; SMN2RAB9ALMNA
SCHEMBL6837491 0.87 THRB (0.51) MAPTSMN1; SMN2TSHRRAB9ANPC1
SCHEMBL6837619 0.87 LMNA (0.49) MAPTSMN1; SMN2TSHRLMNAKMT2A
SCHEMBL6837621 0.87 LMNA (0.49) MAPTSMN1; SMN2TSHRLMNAKMT2A
SCHEMBL6837853 0.86 PDE4A (0.47) MAPTTP53SMN1; SMN2TSHRRAB9A
SCHEMBL6837936 0.85 SMN1; SMN2 (0.49) TP53SMN1; SMN2TSHRLMNAKMT2A

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 MAPT 3600/4885TP53 2008/4885SMN1; SMN2 1477/4885

“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.