SCHEMBL5648162

SCHEMBL5648162

CC1(c2ccccc2)C(=O)N(Cc2ccc3ccc(C=NN)cc3c2)C(=O)N1Cc1cccc(C(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
PTPN1 P18031 5/20 0.38
ACP1 P24666 5/20 0.38
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
PRKAG1 P54619 4/20 0.36
PRKAA2 P54646 4/20 0.36
PRKAB1 Q9Y478 4/20 0.36
NPSR1 Q6W5P4 2/20 0.35
PKM P14618 1/20 0.35
MAPK1 P28482 1/20 0.35
PTPN2 P17706 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.34
MRGPRX4 Q96LA9 1/20 0.34
PLA2G10 O15496 1/20 0.34
KDM4E B2RXH2 1/20 0.34
SIRT1 Q96EB6 1/20 0.34

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
SCHEMBL5648228 0.97 PTPN1 (0.40) KMT2APTPN1ACP1FNTAFNTB
SCHEMBL5650848 0.94 CTRB1 (0.39) KMT2APTPN1ACP1FNTAFNTB
SCHEMBL5649247 0.93 PTPN1 (0.44) KMT2APTPN1ACP1FNTAFNTB
SCHEMBL5647820 0.92 PTPN1 (0.44) KMT2APTPN1ACP1FNTAFNTB
SCHEMBL5650573 0.92 TRPA1 (0.42) KMT2APTPN1NPSR1ALDH1A1MAPT
SCHEMBL5652364 0.91 CTRB1 (0.39) KMT2APTPN1ACP1FNTAFNTB
Trifluoroacetic Acid SCHEMBL5649098 0.90 CTRB1 (0.36) KMT2APTPN1ACP1FNTAFNTB
SCHEMBL5648086 0.89 CTRB1 (0.40) KMT2APTPN1ACP1FNTAFNTB
SCHEMBL5648966 0.89 HPGD (0.41) KMT2APKMALDH1A1KDM4E
SCHEMBL5645171 0.88 CTRB1 (0.40) KMT2APTPN1ACP1FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7199146-B2 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2007-04-03 US disclosed
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-29 US disclosed
US-7053112-B2 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2006-05-30 US disclosed
US-20040122073-A1 Imidazolidinedione analogs useful as anticoagulants and antihrombotics SCHERING AKTIENGESELLSCHAFT (DE) 2004-06-24 US 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 (2 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-20040122073-A1 Imidazolidinedione analogs useful as anticoagulants and antihrombotics SERPINC1, F2, BDKRB1 KMT2A 3162/4885PTPN1 1843/4885ACP1 1675/4885
US-20060142363-A1 Imidazolidinedione analogs useful as anticoagulants and antithrombotics SERPINC1, F2, BDKRB1 KMT2A 3939/4885PTPN1 1936/4885ACP1 2051/4885

“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.