SCHEMBL22745102

SCHEMBL22745102

Cc1ccc2c(c1)-c1ccccc1C2(Cc1ccc(C(=O)C(C)(C)O)cc1)Cc1ccc(C(=O)C(C)(C)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 16/20 0.46
▸ KCNQ2 O43526 2/20 0.36
▸ CYP1A2 P05177 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ APEX1 P27695 1/20 0.35
▸ MAPT P10636 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33

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
SCHEMBL22745101 0.86 PDK2 (0.42) PDK2KCNQ2CYP1A2CYP2C9CYP3A4
SCHEMBL22745113 0.84 PDK2 (0.36) PDK2CYP1A2CYP2C9CYP3A4MAPT
SCHEMBL23567569 0.84 ELANE (0.42) PDK2KCNQ2CYP1A2CYP2C9CYP3A4
SCHEMBL29546340 0.83 KCNQ2 (0.42) PDK2KCNQ2CYP1A2CYP2C9CYP3A4
SCHEMBL23567373 0.83 KCNQ2 (0.42) PDK2KCNQ2CYP1A2CYP2C9CYP3A4
SCHEMBL22745428 0.81 PDK2 (0.49) PDK2APEX1
SCHEMBL22745261 0.81 PDK2 (0.51) PDK2APEX1
SCHEMBL22745256 0.80 MAPK13 (0.38) PDK2
SCHEMBL23567574 0.80 KCNQ2 (0.38) PDK2KCNQ2CYP1A2CYP2C9CYP3A4
SCHEMBL22745171 0.79 PDK2 (0.35) PDK2

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
WO-2020238862-A1 FLUORENE INITIATOR, PHOTOCURABLE COMPOSITION COMPRISING SAME, AND APPLICATION THEREOF 常州强力先端电子材料有限公司 2020-12-03 — — WO disclosed
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