SCHEMBL6958447

SCHEMBL6958447

Cc1ccc2c(c1)C=C(CC(=O)O)CC2

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.40
MCHR1 Q99705 1/20 0.37
MAPT P10636 4/20 0.37
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALOX15 P16050 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
KEAP1 Q14145 3/20 0.36
NFE2L2 Q16236 3/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
CCR5 P51681 2/20 0.35

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
SCHEMBL6953646 0.88 MCHR1 (0.45) SRCMCHR1MAPTALDH1A1SMN1; SMN2
SCHEMBL25606805 0.86 SRC (0.41) SRCMAPTALDH1A1SMN1; SMN2MEN1
SCHEMBL8092415 0.84 BRD4 (0.39) MCHR1MAPTALDH1A1SMN1; SMN2
SCHEMBL6952817 0.81 ADRA2A (0.48) MCHR1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL6949352 0.81 AKR1C2 (0.47) MCHR1ALDH1A1SMN1; SMN2ALOX15KDM4E
SCHEMBL6951250 0.79 PSEN1 (0.40) ALDH1A1MEN1KMT2AKDM4EPTGDR2
SCHEMBL7294400 0.77 HTR1A (0.44) MCHR1GAA
SCHEMBL27500544 0.76 HTR1A (0.34) MCHR1
SCHEMBL10352783 0.72 CCR5 (0.39) MAPTALDH1A1SMN1; SMN2ALOX15KDM4E
SCHEMBL11459982 0.72 MCHR1 (0.45) MCHR1KEAP1NFE2L2PTGDR2

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-1010693-B1 Imidazoline derivatives, preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-09-24 EP disclosed
EP-1010693-A1 Imidazoline derivatives, preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-06-21 EP disclosed