SCHEMBL23049062

SCHEMBL23049062

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nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
MME P08473 2/20 0.31
ACE P12821 2/20 0.31
CPA1 P15085 2/20 0.31
ACE2 Q9BYF1 2/20 0.31
USP2 O75604 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL19230433 1.00 ALDH1A1 (0.31) ALDH1A1MMEACECPA1ACE2
SCHEMBL14614609 1.00 ALDH1A1 (0.31) ALDH1A1MMEACECPA1ACE2
SCHEMBL19230447 1.00 ALDH1A1 (0.31) ALDH1A1MMEACECPA1ACE2
SCHEMBL19545995 1.00 ALDH1A1 (0.31) ALDH1A1MMEACECPA1ACE2
SCHEMBL3527314 0.81 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL196730 0.81 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL3149648 0.81 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL196729 0.81 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL14889910 0.81 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL19729258 0.79 ALDH1A1 (0.31) ALDH1A1

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
EP-3786185-A1 HUMANIZED ANTIBODIES TO LIV-1 AND USE OF SAME TO TREAT CANCER Seagen Inc. (US) 2021-03-03 EP disclosed