SCHEMBL4259898

SCHEMBL4259898

CCCCc1c(-c2ccc(-c3ccc(C(=O)NC(Cc4ccccc4)C(=O)O)cc3)cc2)cn2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
PTPN1 P18031 2/20 0.47
CA1 P00915 2/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
CTSB P07858 1/20 0.45
CTSS P25774 1/20 0.45
CTSK P43235 1/20 0.45
ACE P12821 5/20 0.44
MME P08473 3/20 0.44
CPA1 P15085 3/20 0.44
ACE2 Q9BYF1 3/20 0.44
CA2 P00918 2/20 0.44
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL4259900 1.00 L3MBTL1 (0.49) L3MBTL1PTPN1CA1CA12CA9
SCHEMBL4261543 0.92 L3MBTL1 (0.47) L3MBTL1CTSBCTSSCTSKMEN1
SCHEMBL4261539 0.92 L3MBTL1 (0.47) L3MBTL1CTSBCTSSCTSKMEN1
SCHEMBL4267590 0.84 MMP2 (0.58) ALDH1A1
SCHEMBL4267594 0.84 MMP2 (0.58) ALDH1A1
SCHEMBL6510445 0.80 KDM4E (0.50) L3MBTL1MEN1ALDH1A1KMT2AKDM4E
SCHEMBL4275272 0.80 PPARA (0.59) PTPN1
SCHEMBL28965836 0.77 PTPN1 (0.66) L3MBTL1PTPN1CA1CA12CA9
SCHEMBL28965835 0.77 PTPN1 (0.66) L3MBTL1PTPN1CA1CA12CA9
SCHEMBL2632872 0.75 PTPN1 (0.74) L3MBTL1PTPN1CA1CA12CA9

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-20090082392-A1 Substituted Carboxylic Acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC 2009-03-26 US claimed
US-20040266788-A1 Substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2004-12-30 US claimed
US-20090082392-A1 Substituted Carboxylic Acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC 2009-03-26 US disclosed
US-7358364-B2 treatment of diabetes and/or cancer; useful in the treatment of syndrome X; capable of inhibiting Protein tyrosine phosphatase THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC (US) 2008-04-15 US disclosed
US-20040266788-A1 Substituted carboxylic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2004-12-30 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-20040266788-A1 Substituted carboxylic acids PTP4A1, PTPRS, G6PC1 L3MBTL1 4045/4885PTPN1 11/4885CA1 1086/4885
US-20090082392-A1 Substituted Carboxylic Acids PTPRJ, PTPRS, PTPRG L3MBTL1 4466/4885PTPN1 16/4885CA1 1388/4885

“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.