SCHEMBL29291322

SCHEMBL29291322

Cc1cncnc1.Cc1cncnc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.46
CYP19A1 P11511 2/20 0.42
HCAR2 Q8TDS4 2/20 0.36
ATM Q13315 2/20 0.36
CYP2A6 P11509 1/20 0.33
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
CCR8 P51685 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
ALDH1A1 P00352 1/20 0.32
FKBP5 Q13451 1/20 0.32
KCNH2 Q12809 1/20 0.32
ACHE P22303 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
APLNR P35414 1/20 0.31
LMNA P02545 1/20 0.30
APEX1 P27695 1/20 0.30
PMP22 Q01453 1/20 0.30

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
SCHEMBL10547 1.00
Ammonia Solution, Strong SCHEMBL22189930 0.96
Water SCHEMBL28103775 0.96
Bromide SCHEMBL15548530 0.96
SCHEMBL28239802 0.96
Water SCHEMBL27993523 0.96 GRM5 (0.44) GRM5CYP19A1HCAR2ATMCYP2A6
Hydrochloric Acid SCHEMBL30260944 0.96
Pyridine SCHEMBL28318077 0.83 TSHR (0.47) GRM5CYP19A1HCAR2ATMCYP2A6
SCHEMBL12457573 0.74 CYP2A6 (0.53) GRM5HCAR2ATMCYP2A6
SCHEMBL30240834 0.72

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-109757108-A The Pre-mRNA montage conversion comprising bicyclic holder part of improvement feature with treatment genetic disease adjusts oligonucleotides 比奥马林技术公司 2019-05-14 CN disclosed