SCHEMBL4496337

SCHEMBL4496337

C/C=C/C(=O)Nc1c(C(=O)O)oc2ccccc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.63
ALDH1A1 P00352 3/20 0.56
TSHR P16473 1/20 0.56
TP53 P04637 3/20 0.53
POLB P06746 2/20 0.53
KDM4E B2RXH2 3/20 0.50
HTT P42858 1/20 0.50
MAPK1 P28482 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HTR2C P28335 1/20 0.46
MAPT P10636 3/20 0.45
HPGD P15428 2/20 0.45
TEAD1 P28347 1/20 0.45
YAP1 P46937 1/20 0.45
TEAD4 Q15561 1/20 0.45
TEAD2 Q15562 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
ABCC9 O60706 1/20 0.44
ABCC8 Q09428 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
SCHEMBL4495023 0.85 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TSHRTP53POLB
SCHEMBL4495014 0.85 SMN1; SMN2 (0.58) SMN1; SMN2ALDH1A1TSHRTP53POLB
SCHEMBL2774243 0.84 TSHR (0.76) SMN1; SMN2ALDH1A1TSHRTP53POLB
SCHEMBL13600930 0.82 LMNA (0.69) SMN1; SMN2ALDH1A1TSHRKDM4EHTT
SCHEMBL4496335 0.76 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1TSHRTP53POLB
SCHEMBL29853112 0.74 LMNA (0.62) SMN1; SMN2ALDH1A1TSHRTP53POLB
SCHEMBL18702845 0.74 TP53 (0.55) SMN1; SMN2ALDH1A1TSHRTP53POLB
SCHEMBL29827633 0.72 TP53 (0.77) ALDH1A1TSHRTP53POLBKDM4E
SCHEMBL6857800 0.72 TSHR (0.62) SMN1; SMN2ALDH1A1TSHRPOLBKDM4E
SCHEMBL13600934 0.72 LMNA (0.65) SMN1; SMN2ALDH1A1TSHRKDM4EHTT

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-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 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-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R SMN1; SMN2 2975/4885ALDH1A1 658/4885TSHR 4622/4885

“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.