SCHEMBL29008012

SCHEMBL29008012

CCc1cccnc1OC[C@H]1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 2/20 0.47
ALOX5AP P20292 1/20 0.46
FEN1 P39748 1/20 0.46
POLB P06746 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
GLA P06280 1/20 0.43
F2RL3 Q96RI0 2/20 0.42
GPR119 Q8TDV5 2/20 0.42
CHRNB4 P30926 1/20 0.42
CHRNA3 P32297 1/20 0.42
TSHR P16473 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
OPRD1 P41143 1/20 0.41

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
SCHEMBL29008014 1.00 SSTR4 (0.47) SSTR4ALOX5APFEN1POLBKDM4E
SCHEMBL30181193 1.00 SSTR4 (0.47) SSTR4ALOX5APFEN1POLBKDM4E
SCHEMBL30181627 0.88 ALOX5AP (0.47) SSTR4ALOX5APFEN1POLBKDM4E
SCHEMBL29008081 0.87 ALOX5AP (0.46) ALOX5APFEN1POLBKDM4EF2RL3
SCHEMBL30181179 0.87 ALOX5AP (0.46) ALOX5APFEN1POLBKDM4EF2RL3
SCHEMBL29007782 0.87 SSTR4 (0.47) SSTR4ALOX5APFEN1POLBKDM4E
SCHEMBL14334945 0.87 ALOX5AP (0.50) ALOX5APFEN1POLBKDM4EF2RL3
SCHEMBL14334638 0.87 ALOX5AP (0.50) ALOX5APFEN1POLBKDM4EF2RL3
SCHEMBL29007780 0.87 SSTR4 (0.47) SSTR4ALOX5APFEN1POLBKDM4E
SCHEMBL29007903 0.85 SSTR4 (0.46) SSTR4CHRNB4CHRNA3

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-116157392-A Compounds targeting RNA binding proteins or RNA modification proteins 雷多纳治疗公司 2023-05-23 CN disclosed