SCHEMBL10901243

SCHEMBL10901243

CCCC1(CCC)c2ccccc2C(CCC)(CCC)N1[O]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 2/20 0.36
TP53 P04637 1/20 0.33
PDE7A Q13946 1/20 0.33
ALDH1A1 P00352 3/20 0.33
ELANE P08246 2/20 0.33
SLC9A1 P19634 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
CYP2D6 P10635 1/20 0.32
KDM1A O60341 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GAA P10253 1/20 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
SCHEMBL6872631 0.82 ALDH1A1 (0.41) PGRALDH1A1ELANENPSR1CYP1A2
SCHEMBL10901108 0.78 KDM1A (0.35) PGRPDE7ASMN1; SMN2NPSR1MEN1
SCHEMBL22870080 0.67 PGR (0.40) PGRALDH1A1CYP2D6
SCHEMBL11713230 0.67 SIGMAR1 (0.33) PGRSLC9A1SMN1; SMN2NPSR1ATM
SCHEMBL21130837 0.66 SIGMAR1 (0.47) SMN1; SMN2MAOAMAOB
SCHEMBL15071292 0.65 ALDH1A1 (0.34) PGRTP53ALDH1A1ELANECYP1A2
SCHEMBL8053723 0.65 PGR (0.42) PGRSMN1; SMN2NPSR1CYP2C9CYP2C19
SCHEMBL676795 0.64 PDK2 (0.38) PGRKDM4E
SCHEMBL14449248 0.64 NOTUM (0.33) PGRALDH1A1KDM1AMAOAMAOB
SCHEMBL1617518 0.64 APEX1 (0.53) PGRTP53ALDH1A1SMN1; SMN2NPSR1

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
US-4581429-A Polymerization process and polymers produced thereby COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1986-04-08 US disclosed