SCHEMBL18539145

SCHEMBL18539145

CCOc1cc(/C=C2\SC(=O)N(CCC(=O)O)C2=O)ccc1O

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.81
MEN1 O00255 8/20 0.62
KMT2A Q03164 8/20 0.62
MAPT P10636 7/20 0.62
ALDH1A1 P00352 4/20 0.61
POLB P06746 3/20 0.61
GAA P10253 3/20 0.61
MITF O75030 1/20 0.58
RAB9A P51151 1/20 0.58
NCOA3 Q9Y6Q9 1/20 0.58
ITGB3 P05106 1/20 0.57
ITGAV P06756 1/20 0.57
BAG3 O95817 1/20 0.57
PTPN1 P18031 1/20 0.56
ACP1 P24666 1/20 0.56
PIM1 P11309 1/20 0.55
PIM3 Q86V86 1/20 0.55
PIM2 Q9P1W9 1/20 0.55
NPSR1 Q6W5P4 3/20 0.55
NPC1 O15118 1/20 0.55

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
SCHEMBL21966963 1.00 FABP4 (0.81) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL24220168 0.90 FABP4 (1.00) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL12008425 0.90 FABP4 (1.00) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL13446874 0.84 FABP4 (0.60) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL12008736 0.84 FABP4 (0.89) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL14905143 0.83 NPSR1 (0.76) MEN1KMT2AMAPTALDH1A1POLB
SCHEMBL20558690 0.81 FABP4 (0.81) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL20558689 0.81 FABP4 (0.81) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL12008549 0.81 FABP4 (0.85) FABP4MEN1KMT2AMAPTALDH1A1
SCHEMBL13446876 0.80 FABP4 (0.55) FABP4MEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170049751-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF DASGUPTA RAMANUJ (US) 2017-02-23 US disclosed
US-20170049751-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF DASGUPTA RAMANUJ (US) 2017-02-23 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 (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-20170049751-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF CTNNB1, CTNNA1, CTNNBL1 FABP4 1744/4885MEN1 4655/4885KMT2A 4591/4885

“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.