SCHEMBL5724917

SCHEMBL5724917

COC(=O)c1cccc(CCCNCCCc2cccc(Cl)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.63
CYP4A11 Q02928 3/20 0.63
LOXL2 Q9Y4K0 1/20 0.54
MRGPRX4 Q96LA9 1/20 0.49
CHRM2 P08172 1/20 0.49
PLAAT3 P53816 1/20 0.47
PLAAT5 Q96KN8 1/20 0.47
PLAAT2 Q9NWW9 1/20 0.47
PLAAT4 Q9UL19 1/20 0.47
SLC7A5 Q01650 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
HDAC1 Q13547 1/20 0.46
TRPV1 Q8NER1 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
GAA P10253 1/20 0.45
RAB9A P51151 1/20 0.45
ALDH1A1 P00352 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
SCHEMBL19438684 0.83 PLAAT3 (0.51) CHRM2PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL19078987 0.82 CYP4F2 (0.64) CYP4F2CYP4A11LOXL2MRGPRX4SLC7A5
SCHEMBL19089872 0.82 CYP4F2 (0.64) CYP4F2CYP4A11LOXL2MRGPRX4SLC7A5
SCHEMBL5724857 0.82 CYP4F2 (0.56) CYP4F2CYP4A11LOXL2MRGPRX4SLC7A5
SCHEMBL5046444 0.82 HTT (0.48) CHRM2PLAAT3PLAAT5PLAAT2PLAAT4
SCHEMBL5043162 0.81 MRGPRX4 (0.48) CYP4F2CYP4A11MRGPRX4CHRM2PLAAT3
SCHEMBL5726686 0.81 CYP4F2 (0.55) CYP4F2CYP4A11LOXL2MRGPRX4SLC7A5
SCHEMBL14103993 0.80 CYP4F2 (0.69) CYP4F2CYP4A11LOXL2MRGPRX4SLC7A5
SCHEMBL70173 0.80 CYP4F2 (0.83) CYP4F2CYP4A11LOXL2MRGPRX4SLC7A5
SCHEMBL1792728 0.79 CYP4A11 (0.75) CYP4F2CYP4A11LOXL2MRGPRX4SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0946501-B1 PREVENTION OF LOSS AND RESTORATION OF BONE MASS BY CERTAIN PROSTAGLANDIN AGONISTS PFIZER (US) 2006-05-31 EP disclosed
US-6998423-B2 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC. (US) 2006-02-14 US disclosed
US-20040176461-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC 2004-09-09 US disclosed
US-6649657-B2 Administering amide to treat osteoporosis PFIZER INC. 2003-11-18 US disclosed
US-20030105092-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists CAMERON KIMBERLEY Q (US) 2003-06-05 US disclosed
US-6492412-B2 ADMINISTERING TO A MAMMAL A THERAPEUTICALLY EFFECTIVE AMOUNT OF A COMPOUND OF SULFONAMIDE OR ALKANOY OR AMIDE DERIVATIVE CONTAINING HETERO OR AROMATIC RINGS TO TREAT OSTEOPOROSIS, OSTEOTOMY, CHILDHOOD IDIOPATHIC BOEN LOSS ETC. PFIZER, INC. 2002-12-10 US disclosed
US-20020016368-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists CAMERON KIMBERLY O (US) 2002-02-07 US disclosed
US-6344485-B1 Method for treating glaucoma PFIZER INC. 2002-02-05 US disclosed
US-6288120-B1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists PFIZER INC. 2001-09-11 US disclosed
EP-1000619-A2 Method for treating glaucoma Pfizer Products Inc. (US) 2000-05-17 EP disclosed
EP-0946501-A1 PREVENTION OF LOSS AND RESTORATION OF BONE MASS BY CERTAIN PROSTAGLANDIN AGONISTS PFIZER INC. (US) 1999-10-06 EP disclosed
WO-1998028264-A1 PREVENTION OF LOSS AND RESTORATION OF BONE MASS BY CERTAIN PROSTAGLANDIN AGONISTS PFIZER INC. (US) 1998-07-02 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 (3 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-20040176461-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 CYP4F2 2453/4885CYP4A11 742/4885LOXL2 279/4885
US-20020016368-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 CYP4F2 2453/4885CYP4A11 742/4885LOXL2 279/4885
US-20030105092-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 CYP4F2 2453/4885CYP4A11 742/4885LOXL2 279/4885

“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.