SCHEMBL5725928

SCHEMBL5725928

COC(=O)Cc1cccc(CNCc2ccc(Oc3ccccc3)cc2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.65
KDM4E B2RXH2 2/20 0.65
ALDH1A1 P00352 2/20 0.65
HTT P42858 1/20 0.65
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
HDAC1 Q13547 2/20 0.50
FFAR1 O14842 2/20 0.50
RECQL P46063 1/20 0.50
SLC7A5 Q01650 1/20 0.50
HPGD P15428 1/20 0.47
OPRM1 P35372 1/20 0.47
OPRD1 P41143 1/20 0.47
OPRK1 P41145 1/20 0.47
ATM Q13315 1/20 0.47
BCHE P06276 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
MAPK14 Q16539 1/20 0.46

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
SCHEMBL5047991 0.87 KDM4E (0.62) SMN1; SMN2KDM4EALDH1A1HTTMEN1
SCHEMBL5213552 0.84 SLC7A5 (0.55) SMN1; SMN2KDM4EALDH1A1HTTMEN1
Methane SCHEMBL27618790 0.83 SLC7A5 (0.54) SMN1; SMN2KDM4EALDH1A1HTTMEN1
SCHEMBL5726219 0.83 SLC7A5 (0.49) SMN1; SMN2KDM4EALDH1A1HTTMEN1
SCHEMBL3192546 0.83 SRD5A2 (0.58) SMN1; SMN2KDM4EALDH1A1KMT2AFFAR1
SCHEMBL5726261 0.81 ALDH1A1 (0.48) SMN1; SMN2KDM4EALDH1A1HTTMEN1
SCHEMBL5725462 0.81 SLC7A5 (0.47) SMN1; SMN2KDM4EALDH1A1HTTMEN1
SCHEMBL7227939 0.81 HDAC1 (0.44) SMN1; SMN2KDM4EALDH1A1HTTMEN1
SCHEMBL10243056 0.81 DRD4 (0.60) KDM4EALDH1A1MEN1KMT2AHDAC1
SCHEMBL5725367 0.80 SLC7A5 (0.46) SMN1; SMN2KDM4EALDH1A1HTTMEN1

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 SMN1; SMN2 2441/4885KDM4E 3595/4885ALDH1A1 2216/4885
US-20020016368-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 SMN1; SMN2 2441/4885KDM4E 3595/4885ALDH1A1 2216/4885
US-20030105092-A1 Prevention of loss and restoration of bone mass by certain prostaglandin agonists HPGDS, PTGIR, PTGER1 SMN1; SMN2 2441/4885KDM4E 3595/4885ALDH1A1 2216/4885

“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.