SCHEMBL9056899

SCHEMBL9056899

CCCc1c(C(C)C)c(OC(C)=O)c(SC)c2[nH]c3ccccc3c12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
HTT P42858 2/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PPARG P37231 2/20 0.33
TUBB4A P04350 2/20 0.33
TUBB P07437 2/20 0.33
TUBA3C P0DPH7 2/20 0.33
TUBA1B P68363 2/20 0.33
TUBA4A P68366 2/20 0.33
TUBB4B P68371 2/20 0.33
TUBB3 Q13509 2/20 0.33
TUBB2A Q13885 2/20 0.33
TUBB8 Q3ZCM7 2/20 0.33

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
SCHEMBL8801465 0.75 SLC22A6 (0.40) KDM4EALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL8803144 0.72 SLC22A6 (0.41) KDM4EALDH1A1HPGDHTTRAB9A
SCHEMBL21479880 0.70 GSK3B (0.49) KDM4EHPGDHTTMAPTTP53
SCHEMBL9055605 0.69 KDM4E (0.35) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL9057701 0.69 HTT (0.49) KDM4EALDH1A1HPGDHTTRAB9A
SCHEMBL8388289 0.67 SLC22A6 (0.48) KDM4EALDH1A1HPGDHTTRAB9A
SCHEMBL12708461 0.67 KDM4E (0.56) KDM4EALDH1A1HPGDHTTSMN1; SMN2
SCHEMBL9055602 0.67 GABRP (0.35) KDM4EALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL8389032 0.66 PPARG (0.42) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL8803045 0.66 MAPT (0.37) KDM4EALDH1A1HPGDSMN1; SMN2MAPT

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
WO-1996003377-A1 HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS SANKYO COMPANY, LIMITED (JP) 1996-02-08 WO disclosed