SCHEMBL24446014

SCHEMBL24446014

CCOC(=O)Cc1c[nH]c2ccc(-c3ccc(C)c(C)c3)cc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.62
ICMT O60725 8/20 0.55
SCN9A Q15858 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 2/20 0.48
MEN1 O00255 1/20 0.48
CYP2C9 P11712 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 2/20 0.44
NR4A1 P22736 1/20 0.44
GLA P06280 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 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
SCHEMBL29486510 1.00 PKM (0.62) PKMICMTSCN9ASMN1; SMN2ALDH1A1
SCHEMBL24445971 0.89 ICMT (0.56) PKMICMTALDH1A1KMT2ALMNA
SCHEMBL29486509 0.85 ICMT (0.72) PKMICMTSCN9ASMN1; SMN2ALDH1A1
SCHEMBL24445947 0.85 ICMT (0.72) PKMICMTSCN9ASMN1; SMN2ALDH1A1
SCHEMBL23701735 0.84 TSHR (0.61) ICMTSCN9AALDH1A1KMT2ALMNA
SCHEMBL29486507 0.83 PKM (0.60) PKMICMTSCN9ASMN1; SMN2ALDH1A1
SCHEMBL29486518 0.83 PKM (0.60) PKMICMTSCN9ASMN1; SMN2ALDH1A1
SCHEMBL24445993 0.83 PKM (0.60) PKMICMTSCN9ASMN1; SMN2ALDH1A1
SCHEMBL21808846 0.83 PKM (0.70) PKMICMTSMN1; SMN2ALDH1A1MAPT
SCHEMBL5177499 0.82 PKM (0.68) PKMSMN1; SMN2ALDH1A1MAPTKMT2A

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