SCHEMBL6583173

SCHEMBL6583173

Nc1cc(Cl)c(Cl)cc1C#Cc1ccc(C(=O)O)cc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 14/20 0.53
HPGD P15428 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
MEN1 O00255 1/20 0.51
MITF O75030 1/20 0.51
TP53 P04637 1/20 0.51
XBP1 P17861 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
KMT2A Q03164 1/20 0.51
RELA Q04206 1/20 0.51
MAP4K4 O95819 1/20 0.49
PTGER1 P34995 1/20 0.45

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
SCHEMBL1934576 0.78 HPGD (0.70) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL29179211 0.78 MAP4K4 (0.58) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL6580931 0.77 RXRA (0.54) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL6580918 0.77 MAP4K4 (0.52) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL243754 0.76 MRGPRX4 (0.73) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL9647665 0.74 MRGPRX4 (0.71) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL1600077 0.74 MRGPRX4 (0.62) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL29556736 0.74 MRGPRX4 (0.62) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL10857748 0.72 MRGPRX4 (0.61) MRGPRX4HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL5026568 0.72 XDH (0.71) MRGPRX4HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040235930-A1 Indole derivatives and their use for the treatment of osteoporosis amongst other applications FARINA CARLO (IT) 2004-11-25 US disclosed
EP-1212317-B1 INDOLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF OSTEOPOROSIS AMONGST OTHER APPLICATIONS NIKEM RESEARCH SRL (IT) 2004-09-15 EP disclosed
US-6787550-B1 4-(5,6-DICHLORO-1H-INDOL-2-YL)-3-ETHOXY-N-(2,2,6,6 -TETRAMETHYLTETRAMETHYLPIPERIDIN-4-YL)-BENZAMIDE NIKEM RESEARCH S.R.L. (IT) 2004-09-07 US disclosed
EP-1212317-A1 INDOLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF OSTEOPOROSIS AMONGST OTHER APPLICATIONS GlaxoSmithKline S.p.A. (IT) 2002-06-12 EP disclosed
WO-2001002388-A1 INDOLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF OSTEOPOROSIS AMONGST OTHER APPLICATIONS GLAXOSMITHKLINE S.P.A. (IT) 2001-01-11 WO 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-20040235930-A1 Indole derivatives and their use for the treatment of osteoporosis amongst other applications MALT1, SOST, NFATC1 MRGPRX4 1453/4885HPGD 962/4885NPC1 207/4885

“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.