SCHEMBL27746705

SCHEMBL27746705

COc1ccc(Cc2[c]cc(CCO)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
CALM1 P0DP23 2/20 0.40
SAE1 Q9UBE0 1/20 0.40
UBA2 Q9UBT2 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
F2RL1 P55085 1/20 0.38
LMNA P02545 2/20 0.38
IDO1 P14902 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
MAOB P27338 1/20 0.37
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP2D6 P10635 1/20 0.36
ATM Q13315 1/20 0.36
IGF1R P08069 1/20 0.36
ALOX15 P16050 1/20 0.36

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
SCHEMBL27746677 0.78 TDP1 (0.48) LTA4HTAAR1LMNAIDO1MAOB
SCHEMBL77472 0.77 TAAR1 (0.61) CALM1TAAR1SIGMAR1F2RL1IDO1
SCHEMBL27767691 0.76 LTA4H (0.41) LTA4HSAE1UBA2ALDH1A1SMN1; SMN2
SCHEMBL31497794 0.75 TAAR1 (0.59) CALM1TAAR1SIGMAR1F2RL1IDO1
SCHEMBL6384212 0.74 MAOB (0.49) LTA4HSAE1UBA2IDO1MAOB
SCHEMBL27746669 0.74 KMT2A (0.45) LTA4HSAE1UBA2LMNAKDM4E
SCHEMBL8710179 0.72 MAOB (0.66) CALM1TAAR1SIGMAR1F2RL1IDO1
SCHEMBL27746679 0.71 ESR1 (0.33) LTA4H
SCHEMBL542478 0.70 LTA4H (0.58) LTA4HSAE1UBA2TAAR1SIGMAR1
SCHEMBL22716936 0.70 LMNA (0.44) LTA4HLMNAKDM4EHRH3ALDH1A1

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-101472937-A Benzylphenylglucopyranoside Derivatives DAIICHI SANKYO CO LTD (JP) 2009-07-01 CN disclosed