SCHEMBL6583307

SCHEMBL6583307

COc1cc(C(=O)NC2CCN(CCCCC(=O)O)CC2)ccc1-c1cc2cc(Cl)c(Cl)cc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
HTR4 Q13639 10/20 0.44
UTS2R Q9UKP6 1/20 0.43
DRD4 P21917 2/20 0.43
MCHR1 Q99705 1/20 0.42
POLB P06746 1/20 0.42
DRD2 P14416 1/20 0.42
DRD3 P35462 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL14341052 0.82 HTR4 (0.44) ACHEHTR4UTS2R
SCHEMBL6583304 0.81 ACHE (0.41) ACHEUTS2RDRD4MCHR1KDM4E
SCHEMBL5160953 0.80 IGF1R (0.43) UTS2R
SCHEMBL14341047 0.79 TSHR (0.34) UTS2RPOLBKDM4EALDH1A1KMT2A
SCHEMBL6580849 0.79 DRD4 (0.53) DRD4MCHR1KDM4EALDH1A1KMT2A
SCHEMBL6439903 0.79 MEN1 (0.41) UTS2RALDH1A1KMT2A
SCHEMBL6582845 0.78 ACHE (0.39) ACHEHTR4UTS2RDRD4MCHR1
Hydrochloric Acid SCHEMBL6787079 0.78 DRD4 (0.52) DRD4MCHR1KDM4EALDH1A1KMT2A
SCHEMBL6789259 0.78 ACHE (0.40) ACHEUTS2RMCHR1ALDH1A1
SCHEMBL6582988 0.77 MEN1 (0.54) KMT2A

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 7 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 claimed
EP-1212317-B1 INDOLE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF OSTEOPOROSIS AMONGST OTHER APPLICATIONS NIKEM RESEARCH SRL (IT) 2004-09-15 EP claimed
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 claimed
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 claimed
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 claimed
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

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 ACHE 2084/4885HTR4 368/4885UTS2R 1530/4885

“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.