SCHEMBL21183192

SCHEMBL21183192

CCCCC1(CCCC)c2cc(C(=O)C(=O)OCCC(C)(C)CC)ccc2-c2ccc(C(=O)c3ccc(Sc4ccccc4)cc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.33
▸ PPARA Q07869 1/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ HPGD P15428 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
SCHEMBL21024688 0.91 PDK2 (0.34) PDK2ALDH1A1HPGD
SCHEMBL21183191 0.90 PDK2 (0.34) PDK2ALDH1A1HPGD
SCHEMBL21183150 0.90 PDK2 (0.34) PDK2ALDH1A1HPGD
SCHEMBL21024775 0.88 PDK2 (0.35) PDK2ALDH1A1HPGD
SCHEMBL21024796 0.86 PDK2 (0.35) PDK2ALDH1A1HPGD
SCHEMBL21025036 0.74 PDK2 (0.46) PDK2ALDH1A1HPGD
SCHEMBL21024709 0.72 ALDH1A1 (0.41) ALDH1A1
SCHEMBL21025042 0.70 PDK2 (0.43) PDK2ALDH1A1HPGD
SCHEMBL21025428 0.69 ALDH1A1 (0.45) PDK2ALDH1A1HPGD
SCHEMBL15498434 0.66 MAOA (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3514135-B1 FLUORENE PHOTOINITIATOR, PREPARATION METHOD THEREFOR, PHOTOCURABLE COMPOSITION HAVING SAME, AND USE OF SAME IN PHOTOCURING FIELD CHANGZHOU TRONLY ADVANCED ELECTRONIC MAT CO LTD (CN) 2021-04-21 — — EP disclosed
EP-3514135-A1 FLUORENE PHOTOINITIATOR, PREPARATION METHOD THEREFOR, PHOTOCURABLE COMPOSITION HAVING SAME, AND USE OF SAME IN PHOTOCURING FIELD Changzhou Tronly Advanced Electronic Materials Co., Ltd. (CN) 2019-07-24 — — EP disclosed
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