SCHEMBL31059231

SCHEMBL31059231

OC1CCCC(c2ccccc2)=C1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGF23 Q9GZV9 1/20 0.40
BRD3 Q15059 1/20 0.37
ACHE P22303 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NR3C1 P04150 1/20 0.36
KCNH2 Q12809 1/20 0.36
PTGS2 P35354 1/20 0.36
SLC6A3 Q01959 3/20 0.36
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
GRM5 P41594 3/20 0.35
LMNA P02545 1/20 0.34
SLC18A3 Q16572 1/20 0.34
CFTR P13569 1/20 0.33
GOPC Q9HD26 1/20 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
SCHEMBL31059234 1.00 FGF23 (0.40) FGF23BRD3ACHECYP1A2CYP2C9
SCHEMBL24807917 0.79 SLC6A3 (0.41) FGF23BRD3ACHECYP1A2CYP2C9
SCHEMBL30636598 0.79 FGF23 (0.39) FGF23BRD3ACHECYP1A2CYP2C9
SCHEMBL31059233 0.78 FGF23 (0.37) FGF23PTGS2SLC6A3LMNACFTR
SCHEMBL6810992 0.77 DHODH (0.43) BRD3ACHECYP1A2CYP2C9TSHR
SCHEMBL7486945 0.73 PTGS2 (0.59) ALDH1A1PTGS2
SCHEMBL8192883 0.71 PSIP1 (0.45) PTGS2
SCHEMBL30144692 0.71 SLC6A2 (0.42) FGF23TSHRALDH1A1PTGS2SLC6A3
SCHEMBL30144695 0.71 SLC6A2 (0.42) FGF23TSHRALDH1A1PTGS2SLC6A3
SCHEMBL28835484 0.70 IGF1R (0.38) FGF23ALDH1A1PTGS2SLC6A3SLC6A2

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-119504706-A Macrocyclic compounds having farnesyl transferase inhibitory activity 库拉肿瘤学公司 2025-02-25 CN disclosed
CN-118339152-A Macrocyclic compounds having farnesyl transferase inhibitory activity 库拉肿瘤学公司 2024-07-12 CN disclosed