SCHEMBL28158149

SCHEMBL28158149

O=C(OCC=Cc1ccccc1)c1ccccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.57
▸ TDP1 Q9NUW8 4/20 0.55
▸ MMP1 P03956 1/20 0.55
▸ MMP2 P08253 1/20 0.55
▸ MMP9 P14780 1/20 0.55
▸ MMP12 P39900 1/20 0.55
▸ MAPT P10636 4/20 0.53
▸ BCHE P06276 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ RAB9A P51151 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ ACLY P53396 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ CACNA1B Q00975 1/20 0.49
▸ MAOB P27338 2/20 0.49
▸ HPGD P15428 1/20 0.47
▸ ALOX15 P16050 1/20 0.47

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
SCHEMBL28894463 1.00 EGFR (0.57) EGFRTDP1MMP1MMP2MMP9
SCHEMBL11233694 0.84 EGFR (0.60) EGFRTDP1MMP1MMP2MMP9
SCHEMBL11235978 0.83 KMT2A (0.52) EGFRTDP1MMP1MMP2MMP9
Cinnamyl Anthranilate SCHEMBL14764170 0.83 ALDH1A1 (0.63) EGFRTDP1MMP1MMP2MMP9
Cinnamyl Anthranilate SCHEMBL826956 0.83 ALDH1A1 (0.63) EGFRTDP1MMP1MMP2MMP9
Cinnamyl Anthranilate SCHEMBL826957 0.83 ALDH1A1 (0.63) EGFRTDP1MMP1MMP2MMP9
SCHEMBL10540679 0.82 TDP1 (0.59) TDP1MAPTRAB9AKDM4EKMT2A
SCHEMBL11229669 0.81 MMP1 (0.52) EGFRMMP1MMP2MMP9MMP12
SCHEMBL10935187 0.81 CYSLTR2 (0.48) EGFRTDP1MAPTKDM4ECACNA1B
SCHEMBL6555126 0.81 TDP1 (0.57) TDP1MAPTRAB9AKDM4EKMT2A

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
CN-115362290-A Liquid softener composition 狮王株式会社 2022-11-18 — — CN disclosed
CN-106999973-A System and method for discharging edible material 阿甘芳香和精细化工有限公司 2017-08-01 — — CN disclosed
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