SCHEMBL6921844

SCHEMBL6921844

CCOC(=O)Cc1ccc(O[C@H]2CCN(Cc3ccccc3)C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
HRH3 Q9Y5N1 3/20 0.50
GAA P10253 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SIGMAR1 Q99720 1/20 0.49
CHEK2 O96017 1/20 0.49
ATM Q13315 1/20 0.48
ADRB2 P07550 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
OPRK1 P41145 1/20 0.47
BCHE P06276 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
SCHEMBL14592716 0.86 CHEK2 (0.54) L3MBTL1HRH3GAASMN1; SMN2CHEK2
SCHEMBL6921847 0.84 SIGMAR1 (0.50) L3MBTL1SMN1; SMN2SIGMAR1ATMKDM4E
SCHEMBL13450917 0.81 GAA (0.61) HRH3GAASMN1; SMN2CHEK2BCHE
SCHEMBL13450402 0.81 GAA (0.61) HRH3GAASMN1; SMN2CHEK2BCHE
SCHEMBL10607825 0.79 HRH3 (0.62) HRH3GAASMN1; SMN2CHEK2OPRK1
SCHEMBL4995093 0.79 CHEK2 (0.41) L3MBTL1CHEK2ATMOPRK1BCHE
SCHEMBL4995086 0.79 CHEK2 (0.41) L3MBTL1CHEK2ATMOPRK1BCHE
SCHEMBL10608375 0.79 SIGMAR1 (0.61) HRH3GAASMN1; SMN2SIGMAR1MEN1
Fumaric Acid SCHEMBL10605407 0.78 OPRK1 (0.56) HRH3GAASMN1; SMN2SIGMAR1CHEK2
Fumaric Acid SCHEMBL10605410 0.78 OPRK1 (0.56) HRH3GAASMN1; SMN2SIGMAR1CHEK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6515142-B2 Intermediates of aromatic amidine derivatives which have anticoagulation action DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-02-04 US disclosed
US-20020062033-A1 Process for preparing 2-phenyl-3-naphthylpropionic acid derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-05-23 US disclosed
US-6337405-B1 MULTISTAGE REACTION OF PYRROLE SUBSTITUTED WITH SULFONATE GROUPS AND HYDROXYPHENYLACETIC ACID DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2002-01-08 US disclosed
US-6252088-B1 COUPLING A NITRILE CONTAININ NAPHTHALENE COMPOUND WITH A COMPOUND CONTAINING PROPIONIC ACID GROUP DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-26 US disclosed
EP-0936215-A1 PROCESS FOR PREPARING 2-PHENYL-3-NAPHTHYLPROPIONIC ACID DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-08-18 EP 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-20020062033-A1 Process for preparing 2-phenyl-3-naphthylpropionic acid derivatives PROC, F12, F2 L3MBTL1 4366/4885HRH3 412/4885GAA 2260/4885

“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.