SCHEMBL12008465

SCHEMBL12008465

O=C(CCCN1C(=O)/C(=C/c2ccccc2F)SC1=S)Nc1ccc(O)cc1C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 6/20 0.71
▸ USP2 O75604 1/20 0.71
▸ NSD2 O96028 1/20 0.71
▸ ALPG P10696 1/20 0.71
▸ KMT2A Q03164 11/20 0.67
▸ MEN1 O00255 10/20 0.67
▸ ALPL P05186 1/20 0.63
▸ TNNI3 P19429 1/20 0.61
▸ TNNT2 P45379 1/20 0.61
▸ TNNC1 P63316 1/20 0.61
▸ GFER P55789 1/20 0.60
▸ MAPT P10636 6/20 0.60
▸ L3MBTL1 Q9Y468 3/20 0.60
▸ KDM4E B2RXH2 1/20 0.60
▸ APEX1 P27695 1/20 0.60
▸ RECQL P46063 1/20 0.60
▸ SMN1; SMN2 Q16637 4/20 0.59
▸ MAPK1 P28482 3/20 0.59
▸ HTT P42858 3/20 0.59
▸ ALDH1A1 P00352 2/20 0.59

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
SCHEMBL12008495 0.95 MEN1 (0.74) POLBUSP2NSD2ALPGKMT2A
SCHEMBL12008724 0.89 POLB (0.77) POLBUSP2NSD2ALPGKMT2A
SCHEMBL18545494 0.86 MEN1 (0.56) POLBUSP2NSD2ALPGKMT2A
SCHEMBL12008581 0.86 KMT2A (0.80) POLBKMT2AMEN1TNNI3TNNT2
SCHEMBL12008919 0.84 MEN1 (0.74) POLBUSP2NSD2ALPGKMT2A
SCHEMBL12008714 0.83 KMT2A (0.76) POLBUSP2NSD2ALPGKMT2A
SCHEMBL12008779 0.81 KMT2A (0.90) POLBALPGKMT2AMEN1ALPL
SCHEMBL12008719 0.81 KMT2A (0.70) POLBUSP2NSD2ALPGKMT2A
SCHEMBL12008631 0.81 FFAR1 (0.69) POLBKMT2AMEN1MAPTL3MBTL1
SCHEMBL12008584 0.80 MEN1 (0.87) POLBUSP2NSD2ALPGKMT2A

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 10 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
US-9433611-B2 Oxazole and thiazole compounds as β-catenin modulators and uses thereof NEW YORK UNIVERSITY (US) 2016-09-06 — — US disclosed
US-9433611-B2 Oxazole and thiazole compounds as β-catenin modulators and uses thereof NEW YORK UNIVERSITY (US) 2016-09-06 — — 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-20130109675-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF NEW YORK UNIVERSITY 2013-05-02 — — US disclosed
US-8252823-B2 Oxazole and thiazole compounds as beta-catenin modulators and uses thereof NEW YORK UNIVERSITY (US) 2012-08-28 — — US disclosed
US-8252823-B2 Oxazole and thiazole compounds as beta-catenin modulators and uses thereof NEW YORK UNIVERSITY (US) 2012-08-28 — — US disclosed
US-20090227624-A1 Oxazole and thiazole compounds as beta-catenin modulators and uses thereof US ARMY, SECRETARY OF THE ARMY 2009-09-10 — — US disclosed
US-20090227624-A1 Oxazole and thiazole compounds as beta-catenin modulators and uses thereof US ARMY, SECRETARY OF THE ARMY 2009-09-10 — — 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 (3 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-20090227624-A1 Oxazole and thiazole compounds as beta-catenin modulators and uses thereof CTNNB1, CTNNA1, CTNNBL1 POLB 2088/4885USP2 4060/4885NSD2 3889/4885
US-20170049751-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF CTNNB1, CTNNA1, CTNNBL1 POLB 2088/4885USP2 4060/4885NSD2 3889/4885
US-20130109675-A1 OXAZOLE AND THIAZOLE COMPOUNDS AS BETA-CATENIN MODULATORS AND USES THEREOF CTNNB1, CTNNA1, CTNNBL1 POLB 2088/4885USP2 4060/4885NSD2 3889/4885

“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.

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