SCHEMBL24445987

SCHEMBL24445987

COC(=O)Cc1ccc(-c2ccccc2)ccc[nH]c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
PKM P14618 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
TSHR P16473 3/20 0.45
GAA P10253 2/20 0.45
LMNA P02545 2/20 0.45
ABCC4 O15439 1/20 0.45
PTGS1 P23219 1/20 0.45
HTT P42858 1/20 0.45
CYP4F2 P78329 1/20 0.44
CYP4A11 Q02928 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
MAPT P10636 1/20 0.44
ALDH1A1 P00352 2/20 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
SCHEMBL24612546 0.87 ICMT (0.45) HPGDSMN1; SMN2NPC1RAB9APKM
SCHEMBL24445994 0.86 TAAR1 (0.44)
SCHEMBL1428025 0.84 LMNA (0.62) HPGDSMN1; SMN2NPC1RAB9APKM
SCHEMBL4228874 0.81 CYP4F2 (0.50) HPGDSMN1; SMN2NPC1RAB9ATSHR
SCHEMBL3357146 0.78 GAA (0.55) HPGDSMN1; SMN2NPC1RAB9APKM
SCHEMBL27594421 0.77 HPGD (0.55) HPGDSMN1; SMN2NPC1RAB9APKM
SCHEMBL3358287 0.76 CYP4F2 (0.59) HPGDSMN1; SMN2NPC1RAB9APKM
SCHEMBL24612566 0.73 MMP12 (0.40) LMNAHTTALDH1A1
SCHEMBL7236732 0.73 FFAR1 (0.61) SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL6801321 0.73 LMNA (0.56) HPGDSMN1; SMN2NPC1PKMTSHR

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