SCHEMBL27859359

SCHEMBL27859359

[CH2]C(C)(O)c1ccccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.62
▸ TSHR P16473 3/20 0.62
▸ TDP1 Q9NUW8 2/20 0.62
▸ ALOX15 P16050 4/20 0.41
▸ CA2 P00918 3/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CA12 O43570 1/20 0.41
▸ GMNN O75496 1/20 0.41
▸ EGFR P00533 1/20 0.41
▸ FYN P06241 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CA3 P07451 1/20 0.41
▸ MMP9 P14780 1/20 0.41
▸ HPGD P15428 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
SCHEMBL8733283 0.83 ALDH1A1 (0.65) ALDH1A1TSHRTDP1ALOX15CA2
SCHEMBL9327128 0.82 ALDH1A1 (0.71) ALDH1A1TSHRTDP1ALOX15CA2
SCHEMBL30368089 0.80 ALDH1A1 (0.68) ALDH1A1TSHRTDP1ALOX15CA2
SCHEMBL28056463 0.80 ALDH1A1 (0.68) ALDH1A1TSHRTDP1ALOX15CA2
SCHEMBL548642 0.80 ALDH1A1 (0.68) ALDH1A1TSHRTDP1ALOX15CA2
Ethylene SCHEMBL28844160 0.78 ALDH1A1 (0.90) ALDH1A1TSHRTDP1ALOX15CA2
Tert-Butanol SCHEMBL27621850 0.78 ALDH1A1 (0.90) ALDH1A1TSHRTDP1ALOX15CA2
SCHEMBL410880 0.77 ALDH1A1 (0.71) ALDH1A1TSHRTDP1ALOX15CA2
SCHEMBL51803 0.77 ALDH1A1 (1.00) ALDH1A1TSHRTDP1ALOX15CA2
SCHEMBL22729938 0.77 ALDH1A1 (1.00) ALDH1A1TSHRTDP1ALOX15CA2

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-102498146-A Polymer compositions and methods of making and using the same POLYMERIGHT INC 2012-06-13 — — CN disclosed
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