SCHEMBL8097787

SCHEMBL8097787

CCOC(=O)CC1=Cc2c(cccc2OC)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
MAPT P10636 4/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 3/20 0.38
CYP1A2 P05177 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP2C19 P33261 1/20 0.38
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 2/20 0.37
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
CYP2C9 P11712 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL8091499 0.85 NLRP3 (0.40) MAPTALDH1A1HPGDHSD17B10MEN1
SCHEMBL6957840 0.84 RXRB (0.41) TSHRMAPTALDH1A1HPGDHSD17B10
SCHEMBL8097781 0.83 ADRA2A (0.43) TSHRALDH1A1POLBMEN1KMT2A
SCHEMBL8097604 0.83 ADRA2A (0.43) MAPTALDH1A1HPGDPOLBLMNA
SCHEMBL8091366 0.78 NOTUM (0.43) TSHRALDH1A1HPGDHSD17B10LMNA
SCHEMBL8096734 0.73 PPARG (0.42) TSHRMAPTALDH1A1HPGDRAB9A
SCHEMBL18277350 0.73 TSHR (0.50) TSHRMAPTMAPK1ALDH1A1HPGD
SCHEMBL8970487 0.72 ACHE (0.37) ALDH1A1BCHEACHETDP1
SCHEMBL8092437 0.71 ADRA2A (0.43) TSHRMAPTNPSR1HPGDPOLB
SCHEMBL12668863 0.71 ACHE (0.40) BCHEACHE

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-6127396-A Imidazoline compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US disclosed