SCHEMBL22109548

SCHEMBL22109548

CC(=O)C(CCCNC(N)=O)NC(=O)CNC(=O)CN1C(=O)C=CC1=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ C3AR1 Q16581 1/20 0.39
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KLK7 P49862 1/20 0.35
▸ QRFPR Q96P65 1/20 0.34
▸ SHMT1 P34896 1/20 0.33
▸ ALB P02768 1/20 0.33
▸ POLB P06746 2/20 0.33
▸ RRM1 P23921 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PABPC1 P11940 1/20 0.32
▸ SIRT5 Q9NXA8 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ GSK3A P49840 1/20 0.30
▸ GSK3B P49841 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
SCHEMBL19203573 0.86 PTGS1 (0.40) C3AR1CTDSP1KMT2AALBKDM4E
SCHEMBL13021070 0.83 RRM1 (0.39) KMT2AMEN1ALBPOLBRRM1
SCHEMBL21322508 0.83 SIRT5 (0.37) C3AR1CTDSP1KMT2AMEN1KLK7
SCHEMBL17722911 0.83 FURIN (0.35) C3AR1CTDSP1KMT2AMEN1KLK7
SCHEMBL18937746 0.80 NPY5R (0.40) C3AR1CTDSP1POLBSIRT5
SCHEMBL17722903 0.80 NPY5R (0.40) C3AR1CTDSP1POLBSIRT5
SCHEMBL18937738 0.80 SIRT2 (0.40) SIRT5
SCHEMBL17722926 0.77 KISS1R (0.38) C3AR1CTDSP1POLBSIRT5
SCHEMBL23961685 0.76 C3AR1 (0.45) C3AR1CTDSP1KMT2AMEN1KLK7
SCHEMBL17722924 0.76 NPY5R (0.39) C3AR1CTDSP1KMT2AMEN1KLK7

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-3458102-B1 ANTI-CMET ANTIBODY DRUG CONJUGATES AND METHODS FOR THEIR USE ABBVIE BIOTHERAPEUTICS INC (US) 2020-06-17 — — EP disclosed
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