SCHEMBL13446970

SCHEMBL13446970

CC(=O)c1ccccc1-n1c(C)cc(C=C2SC(=O)N(c3ccccc3)C2=O)c1C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 2/20 0.67
▸ TCF4 P15884 1/20 0.63
▸ CTNNB1 P35222 1/20 0.63
▸ HDAC6 Q9UBN7 1/20 0.63
▸ POLB P06746 3/20 0.52
▸ NPC1 O15118 10/20 0.49
▸ RAB9A P51151 10/20 0.49
▸ ALDH1A1 P00352 7/20 0.49
▸ SMN1; SMN2 Q16637 6/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ KDM4E B2RXH2 3/20 0.49
▸ HTT P42858 3/20 0.49
▸ TNNI3 P19429 1/20 0.49
▸ TNNT2 P45379 1/20 0.49
▸ TNNC1 P63316 1/20 0.49
▸ MEN1 O00255 4/20 0.47
▸ TP53 P04637 1/20 0.47
▸ S1PR4 O95977 4/20 0.46
▸ MAPT P10636 4/20 0.46
▸ S1PR1 P21453 2/20 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
SCHEMBL13446965 0.93 MYC (0.61) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL18545498 0.93 MYC (0.77) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL12009094 0.93 MYC (0.77) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL12009080 0.89 MYC (0.63) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL12009062 0.88 MYC (0.67) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL18545517 0.88 MYC (0.67) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL13446960 0.88 MYC (0.62) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL18545614 0.86 TCF4 (0.69) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL12009116 0.86 TCF4 (0.69) MYCTCF4CTNNB1HDAC6POLB
SCHEMBL13446974 0.86 TCF4 (0.63) MYCTCF4CTNNB1HDAC6POLB

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-9433611-B2 Oxazole and thiazole compounds as β-catenin modulators and uses thereof NEW YORK UNIVERSITY (US) 2016-09-06 — — US disclosed
US-9173871-B2 Oxazole and thiazole compounds as beta-catenin modulators and uses thereof NEW YORK UNIVERSITY (US) 2015-11-03 — — US disclosed
US-20130109675-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF NEW YORK UNIVERSITY 2013-05-02 — — US disclosed
US-20120264744-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF UNITED STATES GOVERNMENT 2012-10-18 — — 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-20120264744-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF CTNNB1, CTNNA1, CTNNBL1 MYC 140/4885TCF4 22/4885CTNNB1 1/4885
US-20130109675-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF CTNNB1, CTNNA1, CTNNBL1 MYC 93/4885TCF4 24/4885CTNNB1 1/4885

“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.

Send feedback