SCHEMBL23201830

SCHEMBL23201830

O=C(N[C@@H](Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(=O)O)c1cc(Cl)ccc1Cl

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 7/20 0.66
▸ ITGB1 P05556 2/20 0.58
▸ ITGA4 P13612 2/20 0.58
▸ LMNA P02545 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ITGB2 P05107 1/20 0.53
▸ ICAM1 P05362 1/20 0.53
▸ ITGAL P20701 1/20 0.53
▸ P2RX1 P51575 2/20 0.50
▸ TMPRSS4 Q9NRS4 2/20 0.50
▸ NHERF1 O14745 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ IKBKB O14920 1/20 0.44
▸ CHUK O15111 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ FLT3 P36888 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ MYLK Q15746 1/20 0.44
▸ P2RX4 Q99571 1/20 0.44

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
SCHEMBL23201831 1.00 PSMB5 (0.66) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL21581968 0.91 ITGB1 (0.67) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL21581967 0.91 ITGB1 (0.67) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL23201868 0.88 PSMB5 (0.66) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL23201866 0.88 PSMB5 (0.66) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL23221762 0.84 PSMB5 (0.69) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL21583747 0.82 ITGB1 (0.57) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL23221680 0.82 ITGB1 (0.57) PSMB5ITGB1ITGA4LMNAHPGD
SCHEMBL23279667 0.81 ITGB2 (0.59) PSMB5ITGB1ITGA4ITGB2ICAM1
SCHEMBL5927201 0.81 ITGB1 (0.66) PSMB5ITGB1ITGA4MRGPRX4KIFC1

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
EP-3805237-B1 SYNTHESIS AND USES OF PEPTIDE BORATE ESTER COMPOUND JIANGSU CHUANGTE PHARMACEUTICAL TECH CO LTD (CN) 2026-01-28 — — EP disclosed
US-11542283-B2 Synthesis of peptide borate ester compound and use thereof JIANGSU CHIA TAI FENGHAI PHARMACEUTICAL CO., LTD. (CN) 2023-01-03 — — US disclosed
US-20210214377-A1 SYNTHESIS OF PEPTIDE BORATE ESTER COMPOUND AND USE THEREOF JIANGSU CHIA TAI FENGHAI PHARMACEUTICAL CO., LTD. (CN) 2021-07-15 — — US disclosed
EP-3805237-A1 SYNTHESIS AND USES OF PEPTIDE BORATE ESTER COMPOUND Jiangsu Chia Tai Fenghai Pharmaceutical Co., Ltd. (CN) 2021-04-14 — — EP 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-20210214377-A1 SYNTHESIS OF PEPTIDE BORATE ESTER COMPOUND AND USE THEREOF SEM1, VIP, PSMB11 PSMB5 38/4885ITGB1 4133/4885ITGA4 4362/4885
US-11542283-B2 Synthesis of peptide borate ester compound and use thereof SEM1, VIP, PSMB11 PSMB5 38/4885ITGB1 4133/4885ITGA4 4362/4885

“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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