SCHEMBL8355712

SCHEMBL8355712

O=C(O)CCCCCCCCCCOc1ccc2c(c1)OCO2

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.68
▸ MAOB P27338 7/20 0.60
▸ MAOA P21397 3/20 0.58
▸ LTB4R Q15722 4/20 0.56
▸ MAPT P10636 4/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ FKBP1A P62942 1/20 0.50
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ACSL1 P33121 1/20 0.49
▸ ACSL6 Q9UKU0 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ ALB P02768 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48

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
SCHEMBL2926027 0.94 TSHR (0.71) TSHRMAOBMAOALTB4RMAPT
SCHEMBL11802724 0.86 MAOB (0.72) TSHRMAOBMAOAMAPTALDH1A1
SCHEMBL28557828 0.86 MAPT (0.54) TSHRMAOBMAOAMAPTALDH1A1
SCHEMBL28564924 0.84 MAPT (0.55) TSHRMAOBMAOAMAPTALDH1A1
SCHEMBL108114 0.81 MAOB (0.74) TSHRMAOBMAOAMAPTALDH1A1
SCHEMBL1520283 0.81 TSHR (1.00) TSHRMAOBMAOAMAPTALDH1A1
SCHEMBL2729496 0.80 FKBP1A (0.63) TSHRMAOBMAOAMAPTALDH1A1
SCHEMBL18686184 0.80 TSHR (0.52) TSHRMAOBMAOALTB4RMAPT
SCHEMBL107322 0.79 MAOB (0.83) TSHRMAOBMAOAMAPTALDH1A1
SCHEMBL11039281 0.79 MAOB (0.62) TSHRMAOBMAOAMAPTALDH1A1

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
WO-1999029640-A2 COMPOSITIONS AND METHODS FOR MODULATING THE ACTIVITY OF FIBROBLAST GROWTH FACTOR EISAI CO., LTD. (JP) 1999-06-17 — — WO claimed
WO-1999029640-A2 COMPOSITIONS AND METHODS FOR MODULATING THE ACTIVITY OF FIBROBLAST GROWTH FACTOR EISAI CO., LTD. (JP) 1999-06-17 — — WO disclosed
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