SCHEMBL14207647

SCHEMBL14207647

CC1CCC(c2ccc(-c3ccc(-c4ccc(C(C)C)cc4)s3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 2/20 0.45
▸ HSD11B1 P28845 1/20 0.36
▸ MCOLN3 Q8TDD5 1/20 0.36
▸ APP P05067 6/20 0.35
▸ HPGD P15428 2/20 0.35
▸ MCHR1 Q99705 1/20 0.35
▸ FFAR1 O14842 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ RAB9A P51151 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ FDPS P14324 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ NOD2 Q9HC29 1/20 0.31

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
SCHEMBL23346027 0.80 ESR2 (0.49) ESR2APPHPGDALDH1A1RAB9A
SCHEMBL13522725 0.78 APP (0.54) ESR2APPHPGDRAB9AKDM4E
SCHEMBL14207673 0.76 ESR2 (0.49) ESR2MCOLN3HPGDMCHR1L3MBTL1
SCHEMBL12769375 0.76 SMN1; SMN2 (0.40) FFAR1ALDH1A1RAB9AKDM4ENPC1
SCHEMBL3723990 0.76 APP (0.52) ESR2APPHPGDRAB9AKDM4E
SCHEMBL22872129 0.75 ESR2 (0.44) ESR2RAB9ANPC1
SCHEMBL11187392 0.74 ESR2 (0.68) ESR2FFAR1RAB9ANPC1TDP1
SCHEMBL11187396 0.74 ESR2 (0.68) ESR2FFAR1RAB9ANPC1TDP1
SCHEMBL11196166 0.72 ESR2 (0.77) ESR2RAB9ANPC1ESR1
SCHEMBL8771638 0.71 ESR2 (0.50) ESR2HSD11B1MCOLN3HPGDFFAR1

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
US-7351451-B2 Anthraquinone compound, liquid crystal composition, cell and display device employing the same FUJIFILM CORPORATION (JP) 2008-04-01 — — US disclosed
US-7351451-B2 Anthraquinone compound, liquid crystal composition, cell and display device employing the same FUJIFILM CORPORATION (JP) 2008-04-01 — — US disclosed
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