SCHEMBL8484287

SCHEMBL8484287

O=C(O)CCC1(c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
EPHX2 P34913 2/20 0.48
CYP2C8 P10632 1/20 0.48
TSHR P16473 1/20 0.47
APEX1 P27695 1/20 0.47
OPRM1 P35372 2/20 0.45
LMNA P02545 2/20 0.44
CNR1 P21554 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
DPP4 P27487 1/20 0.42
AKR1C1 Q04828 1/20 0.42
KEAP1 Q14145 1/20 0.42
OPRL1 P41146 1/20 0.41
NR4A2 P43354 1/20 0.41

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
SCHEMBL8485828 0.92 DPP4 (0.53) EPHX2CYP2C8TSHRLMNAMEN1
SCHEMBL18440285 0.92 EPHX2 (0.52) EPHX2CYP2C8TSHRAPEX1LMNA
SCHEMBL436643 0.91 DPP4 (0.52) EPHX2CYP2C8LMNAMEN1KMT2A
SCHEMBL16986143 0.88 TACR1 (0.49) EPHX2CYP2C8TSHRAPEX1OPRM1
SCHEMBL31147587 0.87 TSHR (0.49) MAOAMAOBTAAR1EPHX2CYP2C8
SCHEMBL31650281 0.83 ALDH1A1 (0.42) EPHX2CYP2C8TSHRAPEX1OPRM1
SCHEMBL435378 0.83 ALDH1A1 (0.51) EPHX2CYP2C8CNR1
SCHEMBL24309995 0.80 ALDH1A1 (0.44) MAOAMAOBTAAR1LMNACNR1
SCHEMBL433785 0.80 EPHX2 (0.53) EPHX2CYP2C8LMNAMEN1KMT2A
SCHEMBL1361875 0.79 TSHR (0.58) MAOAMAOBTAAR1EPHX2TSHR

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
WO-1999015524-A1 THIAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-04-01 WO disclosed