SCHEMBL24064896

SCHEMBL24064896

O=C(O)C(Cc1ccccc1)N1Cc2cc3ccccc3cc2C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
HSD17B10 Q99714 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
ALDH1A1 P00352 2/20 0.53
PKM P14618 1/20 0.53
MAPT P10636 2/20 0.52
ALOX15 P16050 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
KDM4E B2RXH2 1/20 0.50
POLB P06746 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
PTPN7 P35236 1/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL6006397 0.89 LMNA (0.62) LMNAHSD17B10NPSR1ALDH1A1PKM
SCHEMBL24064895 0.77 MAPT (0.74) LMNAALDH1A1PKMMAPTALOX15
SCHEMBL9515787 0.76 LMNA (0.72) LMNAHSD17B10NPSR1ALDH1A1PKM
SCHEMBL4143905 0.76 LMNA (0.71) LMNAHSD17B10NPSR1ALDH1A1PKM
SCHEMBL9277493 0.76 LMNA (0.71) LMNAHSD17B10NPSR1ALDH1A1PKM
SCHEMBL5295982 0.75 TSHR (0.53) LMNAHSD17B10ALDH1A1PKMMAPT
SCHEMBL5295968 0.75 TSHR (0.53) LMNAHSD17B10ALDH1A1PKMMAPT
SCHEMBL4629091 0.74 LMNA (0.56) LMNAHSD17B10ALDH1A1ALOX15KMT2A
Hydrochloric Acid SCHEMBL9096753 0.74 LMNA (0.69) LMNAHSD17B10NPSR1ALDH1A1PKM
SCHEMBL4463271 0.73 LMNA (0.68) LMNAHSD17B10NPSR1ALDH1A1PKM

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-20210372959-A1 Nanopore Method for Identifying Single Amino Acid in Oligopeptides UNIVERSITY OF SOUTH CAROLINA (US) 2021-12-02 US disclosed