SCHEMBL28625523

SCHEMBL28625523

O=Cc1ccc(CCOc2ccc(Br)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
MAPT P10636 2/20 0.57
HPGD P15428 2/20 0.57
LMNA P02545 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAOA P21397 3/20 0.51
MAOB P27338 3/20 0.51
PPARD Q03181 3/20 0.47
PPARA Q07869 3/20 0.47
GPR84 Q9NQS5 1/20 0.47
FFAR1 O14842 2/20 0.45
RAB9A P51151 1/20 0.45
FFAR4 Q5NUL3 1/20 0.45
CHRNA7 P36544 1/20 0.43
PPARG P37231 1/20 0.43
LTA4H P09960 1/20 0.43

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
SCHEMBL12578126 1.00 ALDH1A1 (0.57) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL23627223 0.90 HPGD (0.58) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL4048717 0.85 ALDH1A1 (0.58) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL2232877 0.85 ALDH1A1 (0.58) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL22269585 0.84 ALDH1A1 (0.57) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL2232274 0.83 ALDH1A1 (0.61) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL2231178 0.83 ALDH1A1 (0.66) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL7996783 0.83 MAPT (0.57) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL2232493 0.83 ALDH1A1 (0.63) ALDH1A1MAPTHPGDLMNASMN1; SMN2
SCHEMBL2231514 0.83 ALDH1A1 (0.63) ALDH1A1MAPTHPGDLMNASMN1; SMN2

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-108409837-B Glycopeptide compound with anti-drug resistance bacterial activity, preparation method and application thereof 上海来益生物药物研究开发中心有限责任公司 2021-09-24 CN claimed
CN-108409837-B Glycopeptide compound with anti-drug resistance bacterial activity, preparation method and application thereof 上海来益生物药物研究开发中心有限责任公司 2021-09-24 CN disclosed