SCHEMBL28025665

SCHEMBL28025665

CCC(F)CC(F)COc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
MAOA P21397 1/20 0.46
PTGS1 P23219 1/20 0.46
SCN4A P35499 2/20 0.44
LTA4H P09960 2/20 0.42
MTNR1A P48039 3/20 0.41
MTNR1B P49286 3/20 0.41
CYP2D6 P10635 2/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
KCNA3 P22001 1/20 0.40
CHRNB2 P17787 1/20 0.39
CHRNB4 P30926 1/20 0.39
CHRNA3 P32297 1/20 0.39
CHRNA7 P36544 1/20 0.39
CHRNA4 P43681 1/20 0.39
POLB P06746 1/20 0.39
FFAR1 O14842 1/20 0.39

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
SCHEMBL17425093 0.92 LMNA (0.53) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL1582797 0.90 LMNA (0.44) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL8705465 0.84 LMNA (0.46) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL27688895 0.78 LMNA (0.52) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL27548952 0.78 LMNA (0.50) LMNAMAOAPTGS1SCN4AMTNR1A
SCHEMBL10477052 0.77 KCNA3 (0.50) LMNALTA4HKCNA3CHRNB2CHRNB4
SCHEMBL166337 0.76 LMNA (0.64) LMNACYP2D6ADRB2ADRB1ADRB3
SCHEMBL7101433 0.76 LMNA (0.48) LMNAMAOAPTGS1SCN4AMTNR1A
SCHEMBL28526946 0.75 LMNA (0.57) LMNAMAOAPTGS1SCN4ALTA4H
SCHEMBL11068214 0.75 LMNA (0.57) LMNAMAOAPTGS1SCN4ALTA4H

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
CN-104781267-A Light emitting compounds UNIV NORTHUMBRIA NEWCASTLE 2015-07-15 CN disclosed