SCHEMBL9625015

SCHEMBL9625015

[CH]c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 1/20 0.44
▸ BAD Q92934 1/20 0.44
▸ LPL P06858 1/20 0.41
▸ LIPG Q9Y5X9 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ TXN P10599 1/20 0.39
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA7 P43166 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ PTPN1 P18031 1/20 0.37
▸ PYCR1 P32322 1/20 0.36
▸ NOTUM Q6P988 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ERCC1 P07992 1/20 0.34

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
SCHEMBL98841 0.90 — —
SCHEMBL10337645 0.83 BCL2L1 (0.55) BCL2L1BADLPLLIPGMAOB
SCHEMBL10300262 0.83 BCL2L1 (0.55) BCL2L1BADLPLLIPGMAOB
SCHEMBL26821699 0.83 BCL2L1 (0.55) BCL2L1BADLPLLIPGMAOB
SCHEMBL12562793 0.83 BCL2L1 (0.55) BCL2L1BADLPLLIPGMAOB
SCHEMBL197346 0.83 BCL2L1 (0.55) BCL2L1BADLPLLIPGMAOB
SCHEMBL28060792 0.79 BCL2L1 (0.52) BCL2L1BADLPLLIPGMAOB
SCHEMBL19423241 0.73 BCL2L1 (0.48) BCL2L1BADLPLLIPGMAOB
SCHEMBL2944704 0.73 BCL2L1 (0.48) BCL2L1BADLPLLIPGMAOB
Formaldehyde SCHEMBL27496664 0.73 BCL2L1 (0.55) BCL2L1BADLPLLIPGMAOB

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
EP-0482157-A1 1,3-DIOXANE DERIVATES AND LIQUID CRYSTAL MEDIUM MERCK PATENT GmbH (DE) 1992-04-29 — — EP disclosed
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