SCHEMBL22175351

SCHEMBL22175351

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nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
RRM1 P23921 8/20 0.39
RRM2 P31350 8/20 0.39
RRM2B Q7LG56 8/20 0.39
EPHX1 P07099 1/20 0.39
POLB P06746 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP8 P22894 1/20 0.35
CA9 Q16790 1/20 0.35
FOLH1 Q04609 2/20 0.34
NAALAD2 Q9Y3Q0 2/20 0.34
MME P08473 1/20 0.34

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
SCHEMBL7731906 0.77 CRAT (0.41) ALDH1A1LMNAPOLBCA12CA1
SCHEMBL14269791 0.77 LMNA (0.35) ALDH1A1LMNAPOLBCA12CA1
SCHEMBL1144276 0.77 CRAT (0.41) ALDH1A1LMNAPOLBCA12CA1
SCHEMBL1144295 0.77 CRAT (0.41) ALDH1A1LMNAPOLBCA12CA1
SCHEMBL2821774 0.75 CA12 (0.54) ALDH1A1LMNAPOLBCA12CA1
SCHEMBL16151080 0.73 ALDH1A1 (0.46) ALDH1A1LMNAMEN1KMT2AEPHX1
SCHEMBL25978155 0.73 MME (0.46) ALDH1A1LMNAPOLBMMP1MMP2
SCHEMBL745482 0.72 ALDH1A1 (0.54) ALDH1A1LMNAMEN1KMT2AEPHX1
SCHEMBL17234339 0.72 ITGB3 (0.38) LMNAPOLBCA12CA1CA2
SCHEMBL17234584 0.72 ITGB3 (0.38) LMNAPOLBCA12CA1CA2

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-3078656-B1 AMIDE DERIVATIVES OF N-UREA SUBSTITUTED AMINO ACIDS AS FORMYL PEPTIDE RECEPTOR LIKE-1 (FPRL-1) RECEPTOR MODULATORS ALLERGAN INC (US) 2020-07-01 EP disclosed