SCHEMBL25599537

SCHEMBL25599537

C=C1CC(C)CC(CC[C@H](NC(=O)c2ccc3ccc(Cl)cc3c2OCc2ccc(C(F)(F)F)cc2)C(=O)O)C1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.41
PTPN1 P18031 1/20 0.36
KIFC1 Q9BW19 1/20 0.35
MRGPRX4 Q96LA9 4/20 0.35
MME P08473 1/20 0.34
ACE P12821 1/20 0.34
CPA1 P15085 1/20 0.34
ACE2 Q9BYF1 1/20 0.34
CYP3A4 P08684 4/20 0.34
UGCG Q16739 4/20 0.34
PSMB5 P28074 1/20 0.34
TGM2 P21980 1/20 0.33
NHERF1 O14745 1/20 0.33
SLC6A4 P31645 1/20 0.33
ACACB O00763 1/20 0.33
GPR132 Q9UNW8 1/20 0.32
ITGB1 P05556 1/20 0.32
ITGA4 P13612 1/20 0.32
LRRK2 Q5S007 1/20 0.32

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
SCHEMBL25601942 0.94 CXCR2 (0.39) CXCR2PTPN1CYP3A4UGCGPSMB5
SCHEMBL25599106 0.93 CXCR2 (0.42) CXCR2PTPN1KIFC1MRGPRX4MME
SCHEMBL25599540 0.92 PTPN1 (0.36) CXCR2PTPN1CYP3A4UGCGNHERF1
SCHEMBL25599284 0.91 CXCR2 (0.51) CXCR2PTPN1KIFC1MRGPRX4MME
SCHEMBL25599374 0.91 CXCR2 (0.51) CXCR2PTPN1KIFC1MRGPRX4MME
SCHEMBL25599423 0.89 CXCR2 (0.41) CXCR2PTPN1KIFC1MRGPRX4MME
SCHEMBL25599229 0.89 CXCR2 (0.41) CXCR2PTPN1KIFC1MRGPRX4MME
SCHEMBL25599235 0.88 CXCR2 (0.40) CXCR2PTPN1KIFC1MMEACE
SCHEMBL25599570 0.87 CXCR2 (0.40) CXCR2PTPN1KIFC1MMEACE
SCHEMBL25599003 0.85 CXCR2 (0.40) CXCR2KIFC1MRGPRX4MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159439-A1 ARYLAMIDES AND METHODS OF USE THEREOF GENZYME CORPORATION 2023-05-25 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-20230159439-A1 ARYLAMIDES AND METHODS OF USE THEREOF CFTR, AADAC, ARSA CXCR2 1205/4885PTPN1 1876/4885KIFC1 4789/4885

“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.