SCHEMBL29956687

SCHEMBL29956687

O=Cc1ccccc1OCC(=O)NC1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.67
SMN1; SMN2 Q16637 4/20 0.67
KMT2A Q03164 3/20 0.67
LMNA P02545 3/20 0.67
HTT P42858 1/20 0.67
ALDH1A1 P00352 4/20 0.66
TSHR P16473 2/20 0.66
MEN1 O00255 2/20 0.66
HSD17B10 Q99714 1/20 0.66
PTGDR2 Q9Y5Y4 1/20 0.56
RAB9A P51151 3/20 0.55
NPC1 O15118 1/20 0.55

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
SCHEMBL29952732 0.99 ALDH1A1 (0.68) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL29952949 0.94 HPGD (0.66) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL2556239 0.88 HPGD (0.55) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL29957558 0.82 HPGD (0.54) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL2558648 0.82 SMN1; SMN2 (0.70) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL2753167 0.81 RAB9A (0.81) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL2751080 0.81 KMT2A (0.97) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL2750363 0.81 HPGD (0.97) HPGDSMN1; SMN2KMT2ALMNAHTT
SCHEMBL29957071 0.80 L3MBTL1 (0.62) HPGDSMN1; SMN2KMT2ALMNAALDH1A1
SCHEMBL2561426 0.80 RAB9A (0.60) HPGDSMN1; SMN2KMT2ALMNAHTT

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed