SCHEMBL21667129

SCHEMBL21667129

CC(C)(C)C(=O)OCc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.40
L3MBTL1 Q9Y468 4/20 0.40
RAB9A P51151 3/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP12 P39900 1/20 0.39
ELANE P08246 3/20 0.37
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 2/20 0.36
GLA P06280 1/20 0.36
PRKCA P17252 1/20 0.36
GAA P10253 2/20 0.35
POLB P06746 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 3/20 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
SCHEMBL27255668 0.90 NPC1 (0.38) NPC1L3MBTL1RAB9ACASP3SENP8
SCHEMBL9785598 0.89 NPC1 (0.37) NPC1L3MBTL1RAB9ACASP3SENP8
SCHEMBL14867072 0.82 RIPK1 (0.37) MMP1MMP2MMP9MMP12TDP1
SCHEMBL19276565 0.80 MMP1 (0.35) MMP1MMP2MMP9MMP12TDP1
SCHEMBL13811594 0.80 NPC1 (0.42) NPC1L3MBTL1RAB9ACASP3SENP8
SCHEMBL24961275 0.77 MMP1 (0.46) NPC1L3MBTL1RAB9ACASP3SENP8
SCHEMBL859498 0.77 MMP1 (0.49) NPC1L3MBTL1RAB9ACASP3SENP8
SCHEMBL21266692 0.76 MMP1 (0.37) NPC1RAB9AMMP1MMP2MMP9
SCHEMBL24142266 0.76 MMP1 (0.37) MMP1MMP2MMP9MMP12POLB
SCHEMBL44341 0.76 CA2 (0.46) MMP1MMP2MMP9MMP12ALDH1A1

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-4249519-A1 FLUORINATED PVC COPOLYMER COMPOSITIONS FOR INCREASED ULTRAVIOLET PROTECTION Mexichem Specialty Resins Inc. (US) 2023-09-27 EP disclosed
US-20200040119-A1 BLOCK COPOLYMER AND PREPARATION METHOD AND APPLICATION THEREOF FUDAN UNIVERSITY (CN) 2020-02-06 US disclosed