SCHEMBL30729261

SCHEMBL30729261

COC1(OC)C=CC(C(=O)c2ccccc2O)=C(O)C1.[Na]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
TSHR P16473 2/20 0.41
HPGD P15428 6/20 0.40
CYP2C19 P33261 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
ALOX15 P16050 2/20 0.40
AR P10275 2/20 0.40
PGR P06401 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
CHRM1 P11229 1/20 0.40
TBXA2R P21731 1/20 0.40
SLC6A2 P23975 1/20 0.40
ADRA1A P35348 1/20 0.40
HIF1A Q16665 1/20 0.40
LIG1 P18858 1/20 0.36
ALDH1A1 P00352 7/20 0.34
KDM4E B2RXH2 5/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CA12 O43570 1/20 0.34

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
SCHEMBL28497033 0.84 ALDH1A1 (0.34) LMNATSHRCYP2C19CYP1A2CYP3A4
SCHEMBL10456743 0.82 ALDH1A1 (0.36) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL10632342 0.80 TSHR (0.39) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL424985 0.79 LIG1 (0.41) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL29092707 0.77 ALDH1A1 (0.32) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL29222803 0.75 LMNA (0.35) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL28435553 0.73 ELANE (0.33) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL28441977 0.73 ELANE (0.36) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL3891169 0.72 LMNA (0.37) LMNATSHRHPGDCYP2C19CYP1A2
SCHEMBL28438096 0.71 LMNA (0.38) LMNAHPGDCYP2C19CYP1A2CYP3A4

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
CN-117281519-A Microneedle array, preparation method thereof, microneedle electrode and microneedle sensor 上海傲意信息科技有限公司 2023-12-26 CN disclosed