SCHEMBL8664986

SCHEMBL8664986

NC1(OC(=O)O)CC2CC1C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.39
CYP2C9 P11712 2/20 0.39
ALDH1A1 P00352 4/20 0.34
TSHR P16473 2/20 0.34
LMNA P02545 2/20 0.32
SLC22A2 O15244 1/20 0.32
SLC22A1 O15245 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
NFKB1 P19838 1/20 0.32
STAT6 P42226 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
SLC47A1 Q96FL8 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
SLC1A2 P43004 1/20 0.32
POLB P06746 2/20 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
SCHEMBL906629 0.86 HSD11B1 (0.34) THRBCYP2C9
SCHEMBL6813106 0.74 THRB (0.33) THRBCYP2C9SLC1A2
SCHEMBL865316 0.69 CYP19A1 (0.43) THRBCYP2C9ALDH1A1TSHRMEN1
SCHEMBL9665581 0.68 GRM4 (0.31) CYP2C9ALDH1A1GRM4CYP1A2CYP2C19
Ammonia Solution, Strong SCHEMBL4339903 0.67 CYP19A1 (0.42) THRBCYP2C9ALDH1A1TSHRMEN1
SCHEMBL8663610 0.67 THRB (0.48) THRBCYP2C9TSHRLMNASLC22A2
SCHEMBL9667781 0.65
SCHEMBL5880685 0.64 CYP17A1 (0.43) TSHRMEN1KMT2A
SCHEMBL5179241 0.63 POLB (0.50) THRBCYP2C9TSHRLMNASLC22A2
SCHEMBL25509617 0.63 HSD11B1 (0.34)

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-0750489-B1 INHIBITION OF HAIR GROWTH HANDELMAN JOSEPH H (US) 1998-11-18 EP claimed