SCHEMBL8091366

SCHEMBL8091366

CCOC(=O)CC1=Cc2ccccc2CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
PKM P14618 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HSD17B10 Q99714 1/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR7 P34969 1/20 0.40
HRH1 P35367 1/20 0.40
DRD3 P35462 1/20 0.40
HTR2B P41595 1/20 0.40
ADRA2A P08913 1/20 0.39
TSHR P16473 1/20 0.39
LMNA P02545 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
SCHEMBL10930335 0.86 NOTUM (0.44) NOTUMSMN1; SMN2PKMALDH1A1HSD17B10
SCHEMBL7828758 0.83 SMN1; SMN2 (0.47) NOTUMSMN1; SMN2PKMALDH1A1KDM4E
SCHEMBL7828761 0.83 SMN1; SMN2 (0.47) NOTUMSMN1; SMN2PKMALDH1A1KDM4E
SCHEMBL8092415 0.82 BRD4 (0.39) SMN1; SMN2ALDH1A1L3MBTL1HSD17B10LMNA
SCHEMBL8099968 0.82 MCHR1 (0.42) SMN1; SMN2ALDH1A1L3MBTL1HSD17B10LMNA
SCHEMBL8091499 0.81 NLRP3 (0.40) NOTUMSMN1; SMN2PKMALDH1A1KDM4E
SCHEMBL6954890 0.81 HTR1A (0.43) NOTUMSMN1; SMN2ALDH1A1TDP1HTR1A
SCHEMBL8092437 0.80 ADRA2A (0.43) HPGDADRA2ATSHRLMNA
SCHEMBL8097781 0.79 ADRA2A (0.43) NOTUMSMN1; SMN2ALDH1A1KDM4ETDP1
SCHEMBL8097604 0.79 ADRA2A (0.43) NOTUMSMN1; SMN2ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1183907-C Imidazoline compound, preparing process thereof and pharmaceutical composition contg. same SERVIER LAB (FR) 2005-01-12 CN disclosed
US-6127396-A Imidazoline compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US disclosed
US-4540705-A Antidepressant imidazolines and related compounds STERLING DRUG INC. (US) 1985-09-10 US disclosed
EP-0125410-A2 Imidazolines and related compounds and preparation thereof STERLING DRUG INC. (US) 1984-11-21 EP disclosed