SCHEMBL2179337

SCHEMBL2179337

COc1ccc2c(c1)CCC(C=O)=C2Oc1ccc(OCCN2CCCCC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EBP Q15125 1/20 0.57
SIGMAR1 Q99720 1/20 0.57
HRH3 Q9Y5N1 6/20 0.56
MAOB P27338 1/20 0.52
LTA4H P09960 2/20 0.51
ACHE P22303 2/20 0.47
ESR1 P03372 1/20 0.47

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
SCHEMBL2180695 0.85 EBP (0.60) EBPSIGMAR1HRH3MAOBLTA4H
SCHEMBL2181323 0.84 EBP (0.60) EBPSIGMAR1HRH3MAOBLTA4H
SCHEMBL3118394 0.79 EBP (0.64) EBPSIGMAR1HRH3ESR1
SCHEMBL4163770 0.78 MAOB (0.64) EBPSIGMAR1HRH3MAOBACHE
SCHEMBL8015672 0.74 EBP (0.88) EBPSIGMAR1HRH3LTA4HESR1
SCHEMBL8602973 0.74 EBP (0.64) EBPSIGMAR1HRH3LTA4HESR1
SCHEMBL8015671 0.73 EBP (0.67) EBPSIGMAR1HRH3LTA4HESR1
SCHEMBL7116068 0.73 ESR1 (0.65) EBPSIGMAR1HRH3LTA4HESR1
SCHEMBL7213535 0.73 EBP (0.76) EBPSIGMAR1HRH3MAOBLTA4H
SCHEMBL113833 0.73 EBP (0.73) EBPSIGMAR1HRH3MAOBLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476300-B2 Selective estrogen receptor modulator for the treatment of osteoarthritis ELI LILLY AND COMPANY (US) 2013-07-02 US disclosed
US-8476300-B2 Selective estrogen receptor modulator for the treatment of osteoarthritis ELI LILLY AND COMPANY (US) 2013-07-02 US disclosed
US-8476300-B2 Selective estrogen receptor modulator for the treatment of osteoarthritis ELI LILLY AND COMPANY (US) 2013-07-02 US disclosed
EP-2342189-A2 SELECTIVE ESTROGEN RECEPTOR MODULATOR FOR THE TREATMENT OF OSTEOARTHRITIS ELI LILLY AND COMPANY (US) 2011-07-13 EP disclosed
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ELI LILLY AND COMPANY (US) 2011-07-07 US disclosed
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ELI LILLY AND COMPANY (US) 2011-07-07 US disclosed
US-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ELI LILLY AND COMPANY (US) 2011-07-07 US disclosed
WO-2010036497-A2 SELECTIVE ESTROGEN RECEPTOR MODULATOR ELI LILLY AND COMPANY (US) 2010-04-01 WO disclosed
WO-2010036497-A2 SELECTIVE ESTROGEN RECEPTOR MODULATOR ELI LILLY AND COMPANY (US) 2010-04-01 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-20110166182-A1 Selective Estrogen Receptor Modulator for the Treatment of Osteoarthritis ESRRA, GPER1, ESR2 EBP 120/4885SIGMAR1 391/4885HRH3 2845/4885

“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.