SCHEMBL22840039

SCHEMBL22840039

O=C(O)CNC(=O)N[C@@H](CCCCNC(=O)Nc1ccc(Br)cc1)C(=O)O

nearest known ligand 0.79

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 11/20 0.79
▸ FPR2 P25090 8/20 0.57
▸ ALDH1A1 P00352 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
SCHEMBL20312237 1.00 FOLH1 (0.79) FOLH1FPR2ALDH1A1
SCHEMBL22840014 0.89 FOLH1 (0.78) FOLH1ALDH1A1
SCHEMBL20312213 0.89 FOLH1 (0.78) FOLH1ALDH1A1
SCHEMBL4326441 0.88 FOLH1 (1.00) FOLH1FPR2
SCHEMBL20312183 0.88 FOLH1 (0.63) FOLH1FPR2ALDH1A1
SCHEMBL24585291 0.88 FOLH1 (0.63) FOLH1FPR2ALDH1A1
SCHEMBL22840031 0.88 FOLH1 (0.79) FOLH1
SCHEMBL11977602 0.88 FOLH1 (1.00) FOLH1FPR2
SCHEMBL20312202 0.88 FOLH1 (0.79) FOLH1
SCHEMBL4338893 0.88 FOLH1 (0.91) FOLH1FPR2

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-3335736-B1 HETERODIMERS OF GLUTAMIC ACID MOLECULAR INSIGHT PHARM INC (US) 2020-12-30 — — EP disclosed
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