SCHEMBL24445947

SCHEMBL24445947

CCOC(=O)Cc1c[nH]c2ccc(-c3cccc(C)c3)cc12

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ICMT O60725 9/20 0.72
PKM P14618 1/20 0.63
SCN9A Q15858 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 3/20 0.49
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
KDM4E B2RXH2 1/20 0.45

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
SCHEMBL29486509 1.00 ICMT (0.72) ICMTPKMSCN9ASMN1; SMN2MAPT
SCHEMBL29486518 0.88 PKM (0.60) ICMTPKMSCN9ASMN1; SMN2MAPT
SCHEMBL29486507 0.88 PKM (0.60) ICMTPKMSCN9ASMN1; SMN2MAPT
SCHEMBL24445993 0.88 PKM (0.60) ICMTPKMSCN9ASMN1; SMN2MAPT
SCHEMBL21808846 0.86 PKM (0.70) ICMTPKMSMN1; SMN2MAPTALDH1A1
SCHEMBL29486510 0.85 PKM (0.62) ICMTPKMSCN9ASMN1; SMN2MAPT
SCHEMBL24446014 0.85 PKM (0.62) ICMTPKMSCN9ASMN1; SMN2MAPT
SCHEMBL23701770 0.85 ICMT (0.79) ICMTSCN9AALDH1A1LMNACYP2C9
SCHEMBL9237275 0.84 ICMT (1.00) ICMT
SCHEMBL5177499 0.80 PKM (0.68) PKMSMN1; SMN2MAPTALDH1A1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4026828-A1 AUXIN-INDUCIBLE DEGRON SYSTEM KIT AND USE THEREOF Inter-University Research Institute Corporation Research Organization of Information and Systems (JP) 2022-07-13 EP disclosed
EP-4001414-A1 NONHUMAN ANIMAL AND USE FOR SAME Inter-University Research Institute Corporation Research Organization of Information and Systems (JP) 2022-05-25 EP disclosed