SCHEMBL5094797

SCHEMBL5094797

O=c1c(CO)cc(-c2ccc3c(c2)CCO3)nn1CC1CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
DYRK1A Q13627 2/20 0.39
MAPT P10636 1/20 0.39
CASP3 P42574 1/20 0.38
CASP7 P55210 1/20 0.38
NPC1 O15118 2/20 0.38
ERN1 O75460 2/20 0.37
PLA2G10 O15496 1/20 0.36
CRHR1 P34998 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
FFAR1 O14842 1/20 0.35
NOTUM Q6P988 1/20 0.35
CLK1 P49759 1/20 0.34
PDE4A P27815 1/20 0.34
CYP11B2 P19099 1/20 0.34
NSD2 O96028 1/20 0.34
PADI4 Q9UM07 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL5098222 0.90 DYRK1A (0.41) RAB9ASMN1; SMN2DYRK1AMAPTCASP3
SCHEMBL5101557 0.88 ERN1 (0.35) RAB9ASMN1; SMN2DYRK1AMAPTCASP3
SCHEMBL5107984 0.87 RAB9A (0.37) RAB9ASMN1; SMN2DYRK1AMAPTNPC1
SCHEMBL5094943 0.84 PLA2G10 (0.42) RAB9ASMN1; SMN2DYRK1AMAPTNPC1
SCHEMBL5102133 0.84 CYP11B2 (0.37) RAB9ASMN1; SMN2DYRK1AMAPTNPC1
SCHEMBL5095141 0.84 PTGS1 (0.35) RAB9ASMN1; SMN2DYRK1AMAPTNPC1
SCHEMBL5108547 0.84 SMN1; SMN2 (0.35) RAB9ASMN1; SMN2DYRK1AMAPTNOTUM
SCHEMBL5094916 0.82 GSK3B (0.44) RAB9ASMN1; SMN2DYRK1AMAPTCASP3
SCHEMBL5101723 0.81 NPC1 (0.42) RAB9AMAPTCASP3CASP7NPC1
SCHEMBL5101622 0.80 NPBWR1 (0.46) RAB9AMAPTCASP3CASP7NPC1

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-7314877-B2 Benzofuran derivative KOWA CO., LTD. (JP) 2008-01-01 US disclosed
US-20060189621-A1 Benzofuran derivative KOWA CO., LTD. (JP) 2006-08-24 US disclosed
EP-1602655-A1 BENZOFURAN DERIVATIVE Kowa Co., Ltd. (JP) 2005-12-07 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-20060189621-A1 Benzofuran derivative TNF, TNFRSF1A, RELA RAB9A 4218/4885SMN1; SMN2 4472/4885DYRK1A 4821/4885

“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.