SCHEMBL4285209

SCHEMBL4285209

CC(Nc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
KDM4E B2RXH2 2/20 0.52
APAF1 O14727 1/20 0.52
POLB P06746 1/20 0.52
RECQL P46063 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
STING1 Q86WV6 6/20 0.52
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
LMNA P02545 1/20 0.49
MPO P05164 1/20 0.49
TSHR P16473 1/20 0.49
BLM P54132 1/20 0.49
PMP22 Q01453 1/20 0.49
HIF1A Q16665 1/20 0.49
ALDH1A1 P00352 1/20 0.48
PKM P14618 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NR4A2 P43354 1/20 0.46
CREBBP Q92793 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
SCHEMBL1716641 1.00 MAPT (0.52) MAPTKDM4EAPAF1POLBRECQL
Tryptophan SCHEMBL1716928 0.86 KDM4E (0.74) MAPTKDM4EAPAF1POLBRECQL
SCHEMBL8407071 0.81 ECE1 (0.55) MAPTKDM4EAPAF1POLBRECQL
SCHEMBL27028793 0.80 DHPS (0.49) MAPTKDM4EKMT2AMEN1LMNA
SCHEMBL25571556 0.80 GPR84 (0.50) MAPTKDM4EL3MBTL1STING1KMT2A
SCHEMBL18642525 0.80 HTR6 (0.39)
SCHEMBL461014 0.80 CYP2A6 (0.43) STING1NR4A2
SCHEMBL22582341 0.79 STING1 (0.45) MAPTKDM4EAPAF1POLBRECQL
SCHEMBL27765284 0.79 PBRM1 (0.48) MAPTKDM4EAPAF1POLBRECQL
SCHEMBL28309358 0.78 KDM4E (0.52) KDM4EKMT2AMEN1LMNATSHR

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-7138538-B2 Process for the separation of enantiomers and enantiopure reagent SOLVAY (SOCIETE ANONYME) (BE) 2006-11-21 US claimed
US-20040210060-A1 Process for the separation of enantiomers and enantiopure reagent SOLVAY S.A. (BE) 2004-10-21 US claimed
US-6743373-B1 REAGENT BASED ON ENANTIOPURE AMINO ACID IN WHICH AMINO GROUP CARRIES ACTIVATING GROUP TO FORM ACTIVE PRECURSOR OF ISOCYANATE GROUP AND CARBOXYL GROUP IS SUBSTITUTED; SEPARATION OF ENANTIOMERS HAVING FREE FUNCTIONAL GROUP SOLVAY (SOCIETE ANONYME) (BE) 2004-06-01 US claimed
WO-2009146885-A2 LIPIDATED ANTIBACTERIAL PEPTIDES SPIDERBIOTECH S.R.L. (IT) 2009-12-10 WO disclosed
US-7138538-B2 Process for the separation of enantiomers and enantiopure reagent SOLVAY (SOCIETE ANONYME) (BE) 2006-11-21 US disclosed
US-20040210060-A1 Process for the separation of enantiomers and enantiopure reagent SOLVAY S.A. (BE) 2004-10-21 US disclosed
US-6743373-B1 REAGENT BASED ON ENANTIOPURE AMINO ACID IN WHICH AMINO GROUP CARRIES ACTIVATING GROUP TO FORM ACTIVE PRECURSOR OF ISOCYANATE GROUP AND CARBOXYL GROUP IS SUBSTITUTED; SEPARATION OF ENANTIOMERS HAVING FREE FUNCTIONAL GROUP SOLVAY (SOCIETE ANONYME) (BE) 2004-06-01 US disclosed
EP-1046627-B1 Enantiopure reagents and process for the separation of enantiomers SOLVAY (BE) 2004-02-11 EP disclosed
EP-1046627-A2 Enantiopure reagents and process for the separation of enantiomers SOLVAY (Société Anonyme) (BE) 2000-10-25 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-20040210060-A1 Process for the separation of enantiomers and enantiopure reagent DNPEP, DAO, ANPEP MAPT 3874/4885KDM4E 4407/4885APAF1 2688/4885

“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.