SCHEMBL29924436

SCHEMBL29924436

O=C(O)c1cnc2ncn(CC3(CF)CC3)c2c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.32
HCAR3 P49019 1/20 0.32
SLC22A12 Q96S37 2/20 0.31
RXRA P19793 2/20 0.31
RXRB P28702 2/20 0.31
RXRG P48443 2/20 0.31
TBXA2R P21731 1/20 0.30
MGAM O43451 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
SCHEMBL29770310 0.81 FGFR1 (0.47) HCAR3RXRATBXA2R
SCHEMBL30027893 0.80 PRPS1 (0.33)
SCHEMBL31321914 0.77 TBXA2R (0.38) TBXA2R
SCHEMBL29924896 0.76 GLP1R (0.34) SLC22A12TBXA2R
SCHEMBL31321874 0.75 ALKBH1 (0.32)
SCHEMBL31321924 0.74 HNF4A (0.31)
SCHEMBL29925057 0.73 ALDH1A1 (0.30)
SCHEMBL29480785 0.73 KDM4C (0.42) HCAR3
SCHEMBL30740764 0.73 KDM4C (0.42) HCAR3
SCHEMBL29555150 0.70 BRD4 (0.43)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117751110-A Cycloolefin derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-03-22 CN disclosed
CN-117177970-A Polycyclic derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-05 CN disclosed
WO-2023011539-A1 CYCLOALKENE DERIVATIVE REGULATOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 上海翰森生物医药科技有限公司 2023-02-09 WO disclosed
WO-2022228490-A1 POLYCYCLIC DERIVATIVE MODULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2022-11-03 WO disclosed