SCHEMBL119255

SCHEMBL119255

CC(C)(C)Oc1ccc(C[C@@H](CC(=O)O)NC(=O)OCC2c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.51
▸ ITGB3 P05106 1/20 0.45
▸ ITGA2B P08514 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ MDM2 Q00987 1/20 0.44
▸ MME P08473 3/20 0.43
▸ MMEL1 Q495T6 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ MDM4 O15151 1/20 0.42
▸ TP53 P04637 1/20 0.42

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
SCHEMBL29401661 1.00 CASP3 (0.51) CASP3ITGB3ITGA2BPTPN1MDM2
SCHEMBL29398995 0.90 L3MBTL1 (0.46) CASP3PTPN1MDM2KMT2AMDM4
SCHEMBL21221673 0.88 CASP3 (0.52) CASP3ITGB3ITGA2BPTPN1MME
SCHEMBL119394 0.88 CASP3 (0.57) CASP3ITGB3ITGA2BMMEMMEL1
SCHEMBL3207886 0.88 CASP3 (0.57) CASP3ITGB3ITGA2BMMEMMEL1
SCHEMBL119383 0.88 CASP3 (0.57) CASP3ITGB3ITGA2BMMEMMEL1
SCHEMBL33377860 0.88 CASP3 (0.57) CASP3ITGB3ITGA2BMMEMMEL1
SCHEMBL29400834 0.88 CASP3 (0.57) CASP3ITGB3ITGA2BMMEMMEL1
SCHEMBL119588 0.86 MDM4 (0.51) CASP3ITGB3ITGA2BPTPN1MDM2
SCHEMBL31714182 0.86 MDM4 (0.51) CASP3ITGB3ITGA2BPTPN1MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210198278-A1 SECO MACROLIDE COMPOUNDS SELVITA D.O.O. (HR) 2021-07-01 — — US disclosed
US-10919910-B2 Seco macrolide compounds FIDELTA D.O.O. (HR) 2021-02-16 — — US disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 — — US disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 — — US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 — — US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 — — US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 — — US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 — — 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-20210198278-A1 SECO MACROLIDE COMPOUNDS SEC61B, SEC16A, SEC61A1 CASP3 1238/4885ITGB3 4743/4885ITGA2B 4787/4885
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide GALE, ENGASE, UGGT1 CASP3 2910/4885ITGB3 4415/4885ITGA2B 4478/4885
US-10919910-B2 Seco macrolide compounds SEC61B, SEC16A, SEC61A1 CASP3 1238/4885ITGB3 4743/4885ITGA2B 4787/4885

“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