SCHEMBL6584414

SCHEMBL6584414

OC1(c2cccc(OCc3ccccc3)c2)CCC1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.51
CYP4A11 Q02928 3/20 0.51
MAOB P27338 5/20 0.50
NR4A2 P43354 1/20 0.50
ADAM17 P78536 2/20 0.48
BCHE P06276 1/20 0.48
ALOX5 P09917 2/20 0.47
KDM1A O60341 1/20 0.47
HPD P32754 1/20 0.47
MAOA P21397 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
SCHEMBL2959082 0.97 CYP4F2 (0.51) CYP4F2CYP4A11MAOBNR4A2ADAM17
SCHEMBL9217663 0.87 ALOX5 (0.61) ALOX5
SCHEMBL6042553 0.84 OPRL1 (0.66)
SCHEMBL22091686 0.84 OPRL1 (0.58) CYP4F2CYP4A11MAOBADAM17
SCHEMBL16553890 0.83 LMNA (0.56) MAOBNR4A2BCHEMAOA
SCHEMBL2587746 0.83 ALDH1A1 (0.50) CYP4F2CYP4A11MAOBNR4A2ADAM17
SCHEMBL9352651 0.82 ALOX5 (0.70) CYP4F2CYP4A11ADAM17ALOX5
Ethane SCHEMBL11640556 0.80 MAOB (0.46) CYP4F2CYP4A11MAOBNR4A2ADAM17
SCHEMBL8317190 0.80 NOS2 (0.58) CYP4F2CYP4A11NR4A2
SCHEMBL1660385 0.80 KMT2A (0.46) CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040229911-A1 New pharmaceutical combinations for NOS inhibitors PFIZER INC 2004-11-18 US disclosed
US-20040229911-A1 New pharmaceutical combinations for NOS inhibitors PFIZER INC 2004-11-18 US disclosed
EP-0958282-B1 2-AMINO-6-(2-SUBSTITUTED-4-PHENOXY)-SUBSTITUTED-PYRIDINES PFIZER PROD INC (US) 2004-07-21 EP disclosed
US-20030162765-A1 Use in treatment and prevention of central nervous system and other disorders PFIZER INC. 2003-08-28 US disclosed
US-20010007873-A1 Compounds such as 4-(6-amino-pyridin-2-yl)-3-methoxyphenol as nitric oxide synthase inhibitors used to treat central nervous system disorders, inflammatory disorders, septic shock, etc... PFIZER INC. 2001-07-12 US disclosed
EP-0958282-A1 2-AMINO-6-(2-SUBSTITUTED-4-PHENOXY)-SUBSTITUTED-PYRIDINES Pfizer Products Inc. (US) 1999-11-24 EP disclosed
WO-1998034919-A1 2-AMINO-6-(2-SUBSTITUTED-4-PHENOXY)-SUBSTITUTED-PYRIDINES PFIZER PRODUCTS INC. (US) 1998-08-13 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-20010007873-A1 Compounds such as 4-(6-amino-pyridin-2-yl)-3-methoxyphenol as nitric oxide synthase inhibitors used to treat central nervous system disorders, inflammatory disorders, septic shock, etc... NOS1, PTGS1, NOS2 CYP4F2 216/4885CYP4A11 111/4885MAOB 255/4885
US-20040229911-A1 New pharmaceutical combinations for NOS inhibitors NOS1, NOS3, NPBWR1 CYP4F2 2528/4885CYP4A11 325/4885MAOB 135/4885
US-20030162765-A1 Use in treatment and prevention of central nervous system and other disorders GRIN2C, GRIN2A, CNR2 CYP4F2 388/4885CYP4A11 572/4885MAOB 96/4885

“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.