SCHEMBL29437217

SCHEMBL29437217

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(O)CCO

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 7/20 0.71
NR3C1 P04150 4/20 0.71
PGR P06401 3/20 0.71
ALDH1A1 P00352 3/20 0.71
ADRA1A P35348 1/20 0.71
HTR2B P41595 1/20 0.71
LMNA P02545 7/20 0.68
HSD17B10 Q99714 6/20 0.68
SERPINA6 P08185 6/20 0.68
SMN1; SMN2 Q16637 5/20 0.68
BLM P54132 4/20 0.68
TSHR P16473 4/20 0.68
CYP2C19 P33261 3/20 0.68
PMP22 Q01453 3/20 0.68
HIF1A Q16665 2/20 0.68
CYP3A4 P08684 2/20 0.68
AR P10275 3/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
THRB P10828 1/20 0.67

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
SCHEMBL10892419 0.93 SHBG (0.68) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL14571216 0.93 SHBG (0.68) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL10892429 0.93 SHBG (0.68) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL10891364 0.92 SHBG (0.67) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL10891355 0.92 SHBG (0.67) SHBGNR3C1PGRALDH1A1ADRA1A
Topterone SCHEMBL140769 0.91 SHBG (0.71) SHBGNR3C1PGRALDH1A1ADRA1A
Topterone SCHEMBL3844149 0.91 SHBG (0.71) SHBGNR3C1PGRALDH1A1ADRA1A
Topterone SCHEMBL11730925 0.91 SHBG (0.71) SHBGNR3C1PGRALDH1A1ADRA1A
Topterone SCHEMBL8846971 0.91 SHBG (0.71) SHBGNR3C1PGRALDH1A1ADRA1A
SCHEMBL11728942 0.89 SHBG (0.68) SHBGNR3C1PGRALDH1A1ADRA1A

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
CN-120283732-A Ji Shi tilapia trapping device based on 17,20 beta-p sex pheromone and operation method thereof 上海海洋大学 2025-07-11 CN disclosed
CN-120283732-A Ji Shi tilapia trapping device based on 17,20 beta-p sex pheromone and operation method thereof 上海海洋大学 2025-07-11 CN disclosed