SCHEMBL11552117

SCHEMBL11552117

CC(CCCl)CC(=O)c1ccc2oc3ccc(C(=O)CC(C)CCCl)cc3c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ PTGER1 P34995 1/20 0.38
▸ PTGER3 P43115 1/20 0.38
▸ PTGER2 P43116 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PTGDR Q13258 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ PRMT7 Q9NVM4 2/20 0.36
▸ PRMT5 O14744 1/20 0.36
▸ PRMT3 O60678 1/20 0.36
▸ CARM1 Q86X55 1/20 0.36
▸ EHMT2 Q96KQ7 1/20 0.36

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
SCHEMBL11553445 0.81 TTR (0.39) TTRNPC1RAB9AKDM4EALDH1A1
SCHEMBL11550530 0.78 SIGMAR1 (0.45) ALDH1A1MEN1TP53HPGDKMT2A
SCHEMBL11838004 0.76 TTR (0.45) TTRNPC1RAB9AKDM4EALDH1A1
SCHEMBL11550231 0.76 TTR (0.40) TTRNPC1RAB9AKDM4EALDH1A1
SCHEMBL11550016 0.76 ALDH1A1 (0.54) TTRNPC1RAB9AKDM4EALDH1A1
SCHEMBL11679519 0.75 MAPT (0.49) NPC1RAB9AKDM4EALDH1A1MEN1
SCHEMBL11552376 0.73 TTR (0.43) TTRNPC1RAB9AKDM4EALDH1A1
SCHEMBL11551446 0.72 TTR (0.42) TTRNPC1RAB9AKDM4EALDH1A1
SCHEMBL11552120 0.71 CYP1A2 (0.42) RAB9A
SCHEMBL6841233 0.71 TTR (0.55) TTRNPC1RAB9AKDM4EALDH1A1

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
US-4146624-A METHOD OF TREATING VIRUSES WITH BIS-BASIC KETONES OF DIBENZOFURAN RICHARDSON-MERRELL INC. (US) 1979-03-27 — — US disclosed
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