SCHEMBL30843286

SCHEMBL30843286

COC(=O)c1ccc(F)c2ccn(Cc3ccc(OC(F)(F)F)cc3)c12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.45
PPARA Q07869 2/20 0.45
ABL1 P00519 1/20 0.45
BCR P11274 1/20 0.45
LMNA P02545 1/20 0.44
SERPINE1 P05121 4/20 0.42
KDM4E B2RXH2 1/20 0.41
GCGR P47871 1/20 0.41
IDH1 O75874 1/20 0.41
CHRM1 P11229 1/20 0.40
AMPD2 Q01433 1/20 0.40
HCRTR1 O43613 2/20 0.40
HCRTR2 O43614 2/20 0.40
KLKB1 P03952 1/20 0.40
NR1H4 Q96RI1 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38

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
SCHEMBL21458220 1.00 EPHX2 (0.45) EPHX2PPARAABL1BCRLMNA
SCHEMBL21458301 0.89 EPHX2 (0.48) EPHX2PPARAABL1BCRLMNA
SCHEMBL30843258 0.89 EPHX2 (0.48) EPHX2PPARAABL1BCRLMNA
SCHEMBL21482082 0.86 KDM4E (0.39) LMNAKDM4ECHRM1
SCHEMBL26601878 0.86 L3MBTL1 (0.46) LMNAKDM4ECHRM1
SCHEMBL21458237 0.85 HSP90AA1 (0.39) KDM4ECHRM1
SCHEMBL30843268 0.85 HSP90AA1 (0.39) KDM4ECHRM1
SCHEMBL30843266 0.83 CHRM1 (0.47) SERPINE1KDM4ECHRM1
SCHEMBL21458142 0.83 CHRM1 (0.47) SERPINE1KDM4ECHRM1
SCHEMBL21481836 0.83 NPC1 (0.43) AMPD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3781550-B1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF TEMPEST THERAPEUTICS INC (US) 2024-10-30 EP disclosed
CN-112313208-B Bicyclic carboxamides and methods of use thereof 泰普斯特医疗公司 2024-04-19 CN disclosed