SCHEMBL2007798

SCHEMBL2007798

Oc1ccc(-n2ncc3c(O)cccc32)cc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.41
HSD17B1 P14061 1/20 0.41
HSD17B2 P37059 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP11B1 P15538 3/20 0.38
CYP11B2 P19099 3/20 0.38
TP53 P04637 5/20 0.37
LMNA P02545 2/20 0.37
RXFP1 Q9HBX9 2/20 0.37
GRM1 Q13255 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP19A1 P11511 1/20 0.36
CYP2C9 P11712 1/20 0.36
MAPT P10636 3/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL4437505 0.92 SMN1; SMN2 (0.43) CCR1HSD17B1HSD17B2NPC1RAB9A
SCHEMBL2008736 0.82 CYP11B1 (0.46) HSD17B1HSD17B2NPC1RAB9ASMN1; SMN2
SCHEMBL2008964 0.82 CYP11B1 (0.45) CCR1HSD17B1HSD17B2CYP11B1CYP11B2
SCHEMBL2006806 0.80 NR3C1 (0.42) CCR1CYP11B1CYP11B2GRM1CYP3A4
SCHEMBL27799392 0.78 CYP1A2 (0.51) CCR1RAB9ACYP11B1CYP11B2RXFP1
SCHEMBL4113695 0.77 CYP17A1 (0.54) CCR1CYP11B1CYP11B2CYP17A1CYP1A2
SCHEMBL19051717 0.77 CYP17A1 (0.45) NPC1RAB9ASMN1; SMN2CYP11B1CYP11B2
SCHEMBL2006080 0.75 CYP11B2 (0.46) CCR1NPC1RAB9ACYP11B1CYP11B2
SCHEMBL4448983 0.74 CYP11B1 (0.41) CCR1HSD17B1HSD17B2NPC1RAB9A
SCHEMBL25274445 0.73 XDH (0.47) CCR1RAB9ACYP11B1CYP11B2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7960563-B2 Indazoles used to treat estrogen receptor beta mediated disorders GLAXO GROUP LIMITED (GB) 2011-06-14 US claimed
US-20100087502-A1 Indazoles Used To Treat Estrogen Receptor Beta Mediated Disorders GLAXO GROUP LIMITED (GB) 2010-04-08 US claimed
CN-101679288-A Indazoles for treating estrogen receptor beta mediated diseases GLAXO GROUP LTD 2010-03-24 CN claimed
EP-2118068-A1 INDAZOLES USED TO TREAT ESTROGEN RECEPTOR BETA MEDIATED DISORDERS Glaxo Group Limited (GB) 2009-11-18 EP claimed
WO-2008107455-A1 INDAZOLES USED TO TREAT ESTROGEN RECEPTOR BETA MEDIATED DISORDERS GLAXO GROUP LIMITED (GB) 2008-09-12 WO claimed
US-7960563-B2 Indazoles used to treat estrogen receptor beta mediated disorders GLAXO GROUP LIMITED (GB) 2011-06-14 US disclosed
US-7960563-B2 Indazoles used to treat estrogen receptor beta mediated disorders GLAXO GROUP LIMITED (GB) 2011-06-14 US disclosed
US-7960563-B2 Indazoles used to treat estrogen receptor beta mediated disorders GLAXO GROUP LIMITED (GB) 2011-06-14 US disclosed
US-20100087502-A1 Indazoles Used To Treat Estrogen Receptor Beta Mediated Disorders GLAXO GROUP LIMITED (GB) 2010-04-08 US disclosed
US-20100087502-A1 Indazoles Used To Treat Estrogen Receptor Beta Mediated Disorders GLAXO GROUP LIMITED (GB) 2010-04-08 US disclosed
US-20100087502-A1 Indazoles Used To Treat Estrogen Receptor Beta Mediated Disorders GLAXO GROUP LIMITED (GB) 2010-04-08 US disclosed
CN-101679288-A Indazoles for treating estrogen receptor beta mediated diseases GLAXO GROUP LTD 2010-03-24 CN disclosed
WO-2008107455-A1 INDAZOLES USED TO TREAT ESTROGEN RECEPTOR BETA MEDIATED DISORDERS GLAXO GROUP LIMITED (GB) 2008-09-12 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-20100087502-A1 Indazoles Used To Treat Estrogen Receptor Beta Mediated Disorders GPER1, ESR2, ESRRB CCR1 4035/4885HSD17B1 31/4885HSD17B2 19/4885

“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.