SCHEMBL11747762

SCHEMBL11747762

O=C(Cl)c1ccc2oc3ccc(C(=O)Cl)cc3c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 7/20 0.50
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
BCAT1 P54687 3/20 0.41
STS P08842 2/20 0.40
PIM1 P11309 1/20 0.40
CSNK2A1 P68400 1/20 0.40
AHR P35869 1/20 0.39
PRMT7 Q9NVM4 2/20 0.39
PRMT5 O14744 1/20 0.39
PRMT3 O60678 1/20 0.39
CARM1 Q86X55 1/20 0.39
EHMT2 Q96KQ7 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
PRMT1 Q99873 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
PRMT8 Q9NR22 1/20 0.39
AKR1B1 P15121 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL9535481 0.91 TTR (0.57) TTRNPC1RAB9ABCAT1AHR
SCHEMBL11749377 0.90 TTR (0.63) TTRNPC1RAB9AAKR1B1KDM4E
SCHEMBL28414324 0.84 TTR (0.64) TTRNPC1RAB9AAKR1B1KDM4E
SCHEMBL11841224 0.83 TTR (0.50) TTRAHRLMNAHTTKDM4E
SCHEMBL1783797 0.82 TTR (0.74) TTRNPC1RAB9AKDM4EMEN1
SCHEMBL9691287 0.81 TTR (0.51) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL71110 0.80 TTR (0.68) TTRNPC1RAB9ABCAT1STS
SCHEMBL11550016 0.79 ALDH1A1 (0.54) TTRNPC1RAB9ABCAT1STS
SCHEMBL10788381 0.79 TTR (0.61) TTRNPC1RAB9AAHRLMNA
SCHEMBL2043165 0.78 NPC1 (0.69) TTRNPC1RAB9APRMT7PRMT5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4041165-A TREATING DELAYED HYPERSENSITIVITY RICHARDSON-MERRELL INC. (US) 1977-08-09 US disclosed
US-3953602-A DELAYED HYPERSENSITIVITY RICHARDSON-MERRELL INC. (US) 1976-04-27 US disclosed
US-3937833-A DELAYED HYPERSENSITIVITY RICHARDSON-MERRELL INC. (US) 1976-02-10 US disclosed