SCHEMBL25599487

SCHEMBL25599487

C=C1CC(C)CC(CC[C@H](NC(=O)c2ccc3cc(F)ccc3c2OCc2ccc(OC(F)(F)F)cc2)C(=O)O)C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 1/20 0.34
ITGB3 P05106 5/20 0.34
ITGB1 P05556 5/20 0.34
ITGAV P06756 5/20 0.34
ITGA5 P08648 5/20 0.34
CXCR2 P25025 1/20 0.33
PTPN1 P18031 1/20 0.32
MME P08473 1/20 0.32
ACE P12821 1/20 0.32
CPA1 P15085 1/20 0.32
ACE2 Q9BYF1 1/20 0.32
IDH1 O75874 3/20 0.32
GPR34 Q9UPC5 1/20 0.32
YAP1 P46937 1/20 0.31
KIFC1 Q9BW19 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
CTSL P07711 1/20 0.31
CTSS P25774 1/20 0.31
CTSK P43235 1/20 0.31

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
SCHEMBL25599046 0.91 CXCR2 (0.41) GPR132CXCR2PTPN1YAP1TRPV1
SCHEMBL25599221 0.90 GPR132 (0.35) GPR132ITGB3CXCR2PTPN1ACE
SCHEMBL25599317 0.90 CXCR2 (0.37) ITGB3ITGB1ITGAVITGA5CXCR2
SCHEMBL25599540 0.89 PTPN1 (0.36) GPR132CXCR2PTPN1IDH1YAP1
SCHEMBL25599311 0.89 ITGB3 (0.32) ITGB3ITGB1ITGAVITGA5CXCR2
SCHEMBL25599307 0.88 ITGB1 (0.34) ITGB3ITGB1ITGAVITGA5
SCHEMBL25599235 0.86 CXCR2 (0.40) GPR132CXCR2PTPN1MMEACE
SCHEMBL25599570 0.86 CXCR2 (0.40) GPR132CXCR2PTPN1MMEACE
SCHEMBL25599229 0.85 CXCR2 (0.41) GPR132CXCR2PTPN1MMEACE
SCHEMBL25599423 0.85 CXCR2 (0.41) GPR132CXCR2PTPN1MMEACE

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 GPR132 750/4885ITGB3 3195/4885ITGB1 4082/4885

“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.