SCHEMBL30281157

SCHEMBL30281157

CC(C)c1snnc1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
HSD17B10 Q99714 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
MAPT P10636 2/20 0.34
TSHR P16473 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
LMNA P02545 3/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
COPS5 Q92905 1/20 0.31
ILK Q13418 1/20 0.31

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
SCHEMBL2208458 0.71
SCHEMBL2212373 0.69 ALDH1A1 (0.52) ALDH1A1HSD17B10CYP1A2CYP2C9MAPT
SCHEMBL6246455 0.67
SCHEMBL28873792 0.67
SCHEMBL5717545 0.67 ABCC8 (0.41) ALDH1A1HSD17B10CYP1A2CYP2C9MAPT
SCHEMBL28872781 0.67 ALDH1A1 (0.46) ALDH1A1HSD17B10CYP1A2CYP2C9MAPT
SCHEMBL7662834 0.66 LMNA (0.44) ALDH1A1HSD17B10CYP1A2CYP2C9MAPT
SCHEMBL1432167 0.65 KDM4E (0.46) ALDH1A1MAPTTSHRNPC1PKM
SCHEMBL10175758 0.65 COPS5 (0.39) ALDH1A1CYP1A2CYP2C9NPC1RAB9A
SCHEMBL2213156 0.64 ALDH1A1 (0.44) ALDH1A1TSHRMEN1KMT2ACOPS5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4408530-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2024-08-07 EP disclosed
WO-2023049888-A1 BENZIMIDAZOLES AS MODULATORS OF IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-03-30 WO disclosed
EP-4143195-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 Janssen Pharmaceutica NV (BE) 2023-03-08 EP disclosed