SCHEMBL26544477

SCHEMBL26544477

CCS(=O)(=O)N(C)c1cc(C2CC2)ccc1C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLQ O75417 1/20 0.34
CYP2C9 P11712 1/20 0.33
DRD2 P14416 6/20 0.33
SIGMAR1 Q99720 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
DRD3 P35462 3/20 0.32
HSD11B1 P28845 1/20 0.31
TRIM24 O15164 1/20 0.31
NR1D1 P20393 1/20 0.30
SLC6A4 P31645 1/20 0.30
DRD1 P21728 1/20 0.30
DRD4 P21917 1/20 0.30
DRD5 P21918 1/20 0.30
TYK2 P29597 1/20 0.30
HTR1A P08908 1/20 0.30
HTR2A P28223 1/20 0.30
HTR7 P34969 1/20 0.30

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
SCHEMBL24497698 0.86 TYK2 (0.39) POLQHSD11B1TYK2
SCHEMBL26517467 0.81 POLQ (0.36) POLQCYP2C9DRD2SIGMAR1SPHK1
SCHEMBL24498147 0.81 GAA (0.35) CYP2C9DRD2SIGMAR1SPHK1ALDH1A1
SCHEMBL24498549 0.80 CYP2C9 (0.35) CYP2C9DRD2SIGMAR1SPHK1ALDH1A1
SCHEMBL26030988 0.78 ACSS2 (0.32) POLQCYP2C9DRD2SPHK1ALDH1A1
SCHEMBL24497570 0.78 DRD2 (0.33) CYP2C9DRD2SIGMAR1SPHK1DRD3
SCHEMBL24498237 0.78 NR1D1 (0.34) POLQCYP2C9DRD2SIGMAR1SPHK1
SCHEMBL24497557 0.77 DRD2 (0.32) CYP2C9DRD2SIGMAR1SPHK1ALDH1A1
SCHEMBL29686436 0.76 ALDH1A1 (0.36) ALDH1A1LMNAMAPT
SCHEMBL26118845 0.76 ALDH1A1 (0.36) ALDH1A1LMNAMAPT

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
EP-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 EP disclosed