SCHEMBL28330823

SCHEMBL28330823

CC(C)(C)OC(=O)[C@H](CCCCn1cc(CN)nn1)NC(=O)NC(CCC(=O)O)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 13/20 0.68
▸ FOLH1 Q04609 8/20 0.65

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
SCHEMBL28330826 1.00 DGAT1 (0.68) DGAT1FOLH1
SCHEMBL17599926 0.90 DGAT1 (0.53) DGAT1FOLH1
SCHEMBL17599924 0.90 DGAT1 (0.53) DGAT1FOLH1
SCHEMBL17615122 0.84 DGAT1 (0.49) DGAT1FOLH1
SCHEMBL17599927 0.83 FOLH1 (0.59) DGAT1FOLH1
SCHEMBL17599928 0.83 FOLH1 (0.59) DGAT1FOLH1
SCHEMBL25897923 0.82 DGAT1 (0.79) DGAT1FOLH1
SCHEMBL22957840 0.82 DGAT1 (0.79) DGAT1FOLH1
SCHEMBL21159538 0.81 FOLH1 (0.56) DGAT1FOLH1
SCHEMBL563614 0.81 DGAT1 (1.00) DGAT1FOLH1

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
CN-105407920-B Synthetic antibody mimetic compounds (SyAMs) targeting cancer, particularly prostate cancer 耶鲁大学 2019-12-13 — — CN disclosed
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