SCHEMBL25934356

SCHEMBL25934356

CC(C)Cc1ccc2c(c1)C=CC(=O)C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 4/20 0.45
LMNA P02545 4/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
BCHE P06276 2/20 0.43
ACHE P22303 2/20 0.43
KDM4E B2RXH2 1/20 0.43
THRB P10828 1/20 0.43
PKM P14618 1/20 0.43
IDO1 P14902 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
PTPN1 P18031 1/20 0.43
CES1 P23141 1/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PTPN22 Q9Y2R2 1/20 0.43

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
SCHEMBL10311345 0.81 PTPRC (0.53) PTPRCLMNAMAPTALDH1A1MEN1
SCHEMBL3725061 0.77 SLC7A5 (0.51) PTPRCKDM4EPKMALOX15RECQL
SCHEMBL18639800 0.72 GABRA1 (0.47) LMNAMAPTALDH1A1MEN1POLB
SCHEMBL233251 0.72 NPC1 (0.67) LMNAMAPTALDH1A1MEN1POLB
SCHEMBL19301850 0.71 PTPRC (0.47) PTPRCLMNAMAPTALDH1A1MEN1
SCHEMBL16900338 0.71 PTPRC (0.53) PTPRCLMNAMAPTALDH1A1MEN1
SCHEMBL28689696 0.70 NPC1 (0.65) PTPRCLMNAMAPTALDH1A1MEN1
SCHEMBL20888346 0.70 LMNA (0.46) LMNAMAPTALDH1A1MEN1POLB
SCHEMBL19465353 0.68 PTPRC (0.58) PTPRCLMNAMAPTALDH1A1MEN1
SCHEMBL2525379 0.67 PTPRC (0.52) PTPRCLMNAMAPTALDH1A1MEN1

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-20230242969-A1 PEPTIDE NUCLEIC ACID FUNCTIONALIZED HYDROGEL MICRONEEDLES FOR SAMPLING AND DETECTION OF INTERSTITIAL FLUID NUCLEIC ACIDS HOWARD HUGHES MEDICAL INSTITUTE 2023-08-03 US disclosed