SCHEMBL5736633

SCHEMBL5736633

COc1ccc2oc(C(=O)O)c(O)c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.60
ALDH1A1 P00352 10/20 0.60
SMN1; SMN2 Q16637 8/20 0.57
HSD17B10 Q99714 6/20 0.57
HPGD P15428 6/20 0.57
TP53 P04637 1/20 0.57
HTT P42858 1/20 0.57
NQO1 P15559 1/20 0.57
NPC1 O15118 7/20 0.56
RAB9A P51151 7/20 0.56
MAPT P10636 4/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
LMNA P02545 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54

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
SCHEMBL10372134 0.88 KDM4E (0.73) KDM4EALDH1A1HSD17B10HPGDTP53
SCHEMBL5734812 0.86 KDM4E (0.72) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL6234986 0.84 KDM4E (0.61) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL4763073 0.84 KDM4E (0.78) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL3375173 0.83 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL28292562 0.83 KDM4E (0.58) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL8702456 0.81 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL6720336 0.81 NQO1 (0.64) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL7001218 0.79 KDM4E (0.64) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD
SCHEMBL6240452 0.79 KDM4E (0.53) KDM4EALDH1A1SMN1; SMN2HSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644364-A1 TETRAZOL BENZOFURANCARBOXAMIDES WITH PI3K ACTIVITY AS THERAPEUTIC AGENTS Warner-Lambert Company LLC (US) 2006-04-12 EP disclosed
US-20050020631-A1 3-Substituted benzofurans as therapeutic agents GOGLIOTTI ROCCO DEAN (US) 2005-01-27 US disclosed
WO-2004108709-A1 TETRAZOL BENZOFURANCARBOXAMIDES WITH P13K AKTIVITY AS THERAPEUTIC AGENTS WARNER-LAMBERT COMPANY LLC (US) 2004-12-16 WO disclosed
EP-0187487-B1 BENZOTHIOPHENES AND BENZOFURANS HAVING ANTIALLERGIC ACTIVITY WARNER-LAMBERT COMPANY (US) 1990-08-29 EP disclosed
US-4703053-A Benzothiophenes and benzofurans and antiallergic use thereof WARNER-LAMBERT COMPANY (US) 1987-10-27 US disclosed
EP-0187487-A1 Benzothiophenes and benzofurans having antiallergic activity WARNER-LAMBERT COMPANY (US) 1986-07-16 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-20050020631-A1 3-Substituted benzofurans as therapeutic agents CYP4F11, BPTF, F3 KDM4E 2213/4885ALDH1A1 103/4885SMN1; SMN2 2260/4885

“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.