SCHEMBL29617617

SCHEMBL29617617

COC(=O)C(C)[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)CN(Cc2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ HIF1A Q16665 4/20 0.45
▸ EPAS1 Q99814 4/20 0.45
▸ CHRM2 P08172 1/20 0.42
▸ CHRM5 P08912 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM3 P20309 1/20 0.42
▸ SIGMAR1 Q99720 2/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ TEAD1 P28347 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ FAAH O00519 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ PRKAB2 O43741 1/20 0.40
▸ PRKAG1 P54619 1/20 0.40
▸ PRKAA2 P54646 1/20 0.40
▸ PRKAA1 Q13131 1/20 0.40

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
SCHEMBL27136637 0.88 L3MBTL1 (0.46) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29617606 0.88 L3MBTL1 (0.46) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL26970080 0.88 L3MBTL1 (0.46) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29617642 0.88 L3MBTL1 (0.46) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29087751 0.88 HIF1A (0.41) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29087753 0.88 HIF1A (0.41) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29087693 0.80 HIF1A (0.43) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29087696 0.80 HIF1A (0.43) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29087755 0.78 KDM4E (0.43) L3MBTL1HIF1AEPAS1CHRM2CHRM5
SCHEMBL29617620 0.78 KDM4E (0.43) L3MBTL1HIF1AEPAS1CHRM2CHRM5

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-4247374-A1 SMALL MOLECULE COMPOUNDS AND COMPOSITIONS Telo Therapeutics, Inc. (US) 2023-09-27 — — EP disclosed
WO-2022109209-A1 SMALL MOLECULE COMPOUNDS AND COMPOSITIONS TELO THERAPEUTICS, INC. (US) 2022-05-27 — — WO disclosed
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