SCHEMBL21048972

SCHEMBL21048972

Cc1ccc(C(=O)c2cc3ccc2-3)c(C)c1C.O=PO

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.35
AKR1C3 P42330 2/20 0.33
AKR1C2 P52895 2/20 0.33
AKR1B10 O60218 1/20 0.33
AKR1C4 P17516 1/20 0.33
AKR1C1 Q04828 1/20 0.33
RXRA P19793 2/20 0.32
RARA P10276 1/20 0.32
MAPK14 Q16539 1/20 0.32
RXRB P28702 1/20 0.31
FABP4 P15090 1/20 0.31
TDP2 O95551 1/20 0.31
NSD2 O96028 1/20 0.31
HSP90AA1 P07900 1/20 0.31
PAX8 Q06710 1/20 0.31
CYP2C8 P10632 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
HSD17B1 P14061 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL22129964 0.92 MCL1 (0.37) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
Phosphine SCHEMBL7063996 0.92 MCL1 (0.37) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
SCHEMBL27940198 0.90 MCL1 (0.36) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
Phosphonic Acid SCHEMBL27941919 0.88 MCL1 (0.35) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
Phosphonic Acid SCHEMBL28230146 0.86 MCL1 (0.34) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
SCHEMBL28465134 0.85 NPC1 (0.33) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
SCHEMBL27845228 0.82 KDM4E (0.35) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
SCHEMBL27945929 0.80 HDAC7 (0.36) MCL1SMN1; SMN2
Ethyl Hydrogen Phosphonate SCHEMBL27562760 0.79 NPC1 (0.33) MCL1AKR1C3AKR1C2AKR1B10AKR1C4
SCHEMBL28797066 0.79 MEN1 (0.44) AKR1C3AKR1C2AKR1B10AKR1C1MAPK14

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-3206753-B1 LATEX NAIL COMPOSITIONS HAVING LOW AMOUNTS OF PHOTO-INITIATOR OREAL (FR) 2019-06-12 EP claimed