SCHEMBL3864558

SCHEMBL3864558

CC(C)(C)OC(=O)Oc1ccc(CC(NC(=O)OCc2ccccc2)C(=O)OCOC(=O)C(C)(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.50
ITGA2B P08514 7/20 0.50
P2RX7 Q99572 7/20 0.46
CTSL P07711 2/20 0.46
CTSK P43235 2/20 0.46
CTSB P07858 1/20 0.46
CTSS P25774 1/20 0.46
ALDH1A1 P00352 1/20 0.45
ALOX15 P16050 1/20 0.45
SYK P43405 1/20 0.45

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
SCHEMBL3865096 0.87 ITGB3 (0.64) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL3865100 0.87 ITGB3 (0.64) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL7748647 0.80 SYK (0.63) CTSLCTSKCTSBCTSSSYK
SCHEMBL18025361 0.80 BCL2 (0.63) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL19485480 0.79 CTSK (0.62) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL9219338 0.79 CTSK (0.62) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL6780588 0.79 CTSS (0.54) ITGB3ITGA2BCTSLCTSKCTSB
SCHEMBL25320494 0.79 HDAC8 (0.58) ITGB3ITGA2BP2RX7CTSLCTSK
SCHEMBL2058984 0.79 ITGB3 (0.53) ITGB3ITGA2BP2RX7CTSLCTSK
SCHEMBL16320655 0.77 ITGB3 (0.54) ITGB3ITGA2BP2RX7CTSLCTSK

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-7521469-B2 Phosphinic amino acid compounds LES LABORATOIRES SERVIER (FR) 2009-04-21 US disclosed
US-20080153890-A1 Phosphinic Amino Acid Compounds LES LABORATOIRES SERVER (FR) 2008-06-26 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-20080153890-A1 Phosphinic Amino Acid Compounds NPR1, NPPA, AADAT ITGB3 3973/4885ITGA2B 4471/4885P2RX7 700/4885

“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.