SCHEMBL25553889

SCHEMBL25553889

NC12CCC(C(NC(=O)c3ccc4cccnc4c3OCc3ccc(C(F)(F)F)cc3)C(=O)O)(CC1)C2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 3/20 0.42
▸ CXCR2 P25025 1/20 0.41
▸ MAPT P10636 4/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ PPIA P62937 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.35
▸ GPR132 Q9UNW8 1/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ AURKA O14965 1/20 0.34
▸ RPS6KB1 P23443 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34
▸ CYP3A4 P08684 3/20 0.33
▸ UGCG Q16739 3/20 0.33
▸ KIFC1 Q9BW19 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ LRRK2 Q5S007 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MME P08473 1/20 0.33

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
SCHEMBL25548999 1.00 EGLN1 (0.42) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL25601641 0.87 CXCR2 (0.44) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL23460143 0.87 CXCR2 (0.44) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL23460144 0.87 CXCR2 (0.44) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL25549159 0.86 EGLN1 (0.42) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL25556126 0.86 EGLN1 (0.42) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL23459945 0.86 EGLN1 (0.43) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL23459947 0.86 EGLN1 (0.43) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL25599253 0.86 EGLN1 (0.43) EGLN1CXCR2MAPTALDH1A1KDM4E
SCHEMBL25549184 0.85 CXCR2 (0.44) EGLN1CXCR2MAPTALDH1A1KDM4E

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-20230159438-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-20230159438-A1 ARYLAMIDES AND METHODS OF USE THEREOF CFTR, AADAC, ARSA EGLN1 623/4885CXCR2 1205/4885MAPT 4871/4885

“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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