SCHEMBL26936759

SCHEMBL26936759

CC(C)COc1cccc(N=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 1/20 0.46
▸ TRIM24 O15164 1/20 0.46
▸ NR1H4 Q96RI1 2/20 0.44
▸ KAT6A Q92794 2/20 0.41
▸ FOS P01100 1/20 0.40
▸ JUN P05412 1/20 0.40
▸ MTNR1A P48039 3/20 0.40
▸ MTNR1B P49286 3/20 0.40
▸ ADRB2 P07550 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ XBP1 P17861 1/20 0.40
▸ HSD17B1 P14061 1/20 0.39
▸ HSD17B2 P37059 1/20 0.39
▸ HTR1D P28221 1/20 0.38
▸ HTR1B P28222 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38

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
SCHEMBL25959894 0.84 TOP1 (0.43) SIRT2MTNR1AMTNR1BADRB2HTR1D
SCHEMBL2967940 0.81 TRIM24 (0.55) SIRT2TRIM24NR1H4KAT6AFOS
SCHEMBL5532468 0.80 TP53 (0.53) POLBMAPTHPGDKMT2AMAPK1
SCHEMBL9647573 0.77 TRIM24 (0.49) SIRT2TRIM24NR1H4KAT6AFOS
SCHEMBL5786398 0.74 MAPK1 (0.64) TRIM24MTNR1AMTNR1BKMT2ATSHR
SCHEMBL3723068 0.74 ADRB2 (0.59) TRIM24ADRB2MAPTKMT2A
SCHEMBL8050864 0.74 TRIM24 (0.47) SIRT2TRIM24NR1H4KAT6AFOS
SCHEMBL14878920 0.74 MAPK1 (0.37) KMT2ATSHRMAPK1
SCHEMBL8048490 0.74 TRIM24 (0.47) SIRT2TRIM24NR1H4KAT6AFOS
SCHEMBL14314265 0.74 RAB9A (0.40) MAPTKMT2ATSHRMAPK1

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-4289823-A1 SUBSTITUTED PYRIDAZINE PHENOL DERIVATIVES Medshine Discovery Inc. (CN) 2023-12-13 — — EP disclosed
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