SCHEMBL5075346

SCHEMBL5075346

O=C1CCCC1(CCCCCCc1nn[nH]n1)CCC(O)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.35
PIN1 Q13526 2/20 0.35
CES1 P23141 1/20 0.35
NCEH1 Q6PIU2 1/20 0.35
FFAR2 O15552 3/20 0.35
LTB4R Q15722 2/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
HSD11B1 P28845 1/20 0.34
CYSLTR2 Q9NS75 3/20 0.33
CYSLTR1 Q9Y271 3/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL5072191 0.83 PTGER4 (0.31) PTGER4
SCHEMBL5613040 0.81 PTGER4 (0.35) PTGER4L3MBTL1PIN1LTB4RLTB4R2
SCHEMBL5075349 0.72 PTGER4 (0.52) PTGER4L3MBTL1CES1NCEH1
SCHEMBL5605038 0.70
SCHEMBL7946127 0.66 TSHR (0.30) TSHR
SCHEMBL6558651 0.65 PTGER3 (0.61) PTGER4
SCHEMBL6557846 0.64 PTGER4 (0.55) PTGER4
SCHEMBL5604828 0.64 PTGER4 (0.43) PTGER4PIN1FFAR2CYSLTR2CYSLTR1
SCHEMBL29424287 0.63 PTGER4 (1.00) PTGER4
SCHEMBL9986079 0.63 L3MBTL1 (0.67) PTGER4L3MBTL1CES1NCEH1LTB4R

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-7255984-B2 Combination therapy for osteoporosis PFIZER INC. (US) 2007-08-14 US claimed
US-20010009920-A1 Estrogen agonist/antagonist and a prostaglandin or a prostaglandin agonist/antagonist KE HUA ZHU (US) 2001-07-26 US claimed
EP-0883404-A1 COMBINATION THERAPY FOR OSTEOPOROSIS PFIZER INC. (US) 1998-12-16 EP claimed
WO-1997031640-A1 COMBINATION THERAPY FOR OSTEOPOROSIS PFIZER INC. (US) 1997-09-04 WO claimed
EP-1932543-A2 Combination therapy for osteoporosis consisting of an estrogen agonist/antagonist and a growth hormone secretagogue Pfizer, Inc. (US) 2008-06-18 EP disclosed
EP-1236475-A2 Combination therapy for osteoporosis consisting of an estrogen agonist/antagonist and a growth hormone secretagogue PFIZER INC. (US) 2002-09-04 EP disclosed
US-6323232-B1 TREATMENT OF OSTEOPOROSIS WITH LASOFOXIFENE AND PGE2 PFIZER INC. 2001-11-27 US disclosed
EP-0883404-A1 COMBINATION THERAPY FOR OSTEOPOROSIS PFIZER INC. (US) 1998-12-16 EP disclosed
WO-1997031640-A1 COMBINATION THERAPY FOR OSTEOPOROSIS PFIZER INC. (US) 1997-09-04 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-20010009920-A1 Estrogen agonist/antagonist and a prostaglandin or a prostaglandin agonist/antagonist PTGER1, PTGER2, PTGER4 PTGER4 3/4885L3MBTL1 4604/4885PIN1 2193/4885

“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.