SCHEMBL11208284

SCHEMBL11208284

[NH]C(=O)CSc1ccc(O)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.43
GAA P10253 4/20 0.43
KDM4E B2RXH2 3/20 0.43
MAPT P10636 3/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALPL P05186 2/20 0.40
ALPG P10696 2/20 0.40
ALPI P09923 1/20 0.40
PLAA Q9Y263 1/20 0.40
ANPEP P15144 1/20 0.38
APEX1 P27695 2/20 0.37
RGS12 O14924 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37

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
SCHEMBL9463126 0.82 FFAR1 (0.55) POLBGAAKDM4EMAPTHTT
SCHEMBL11208287 0.81 SMN1; SMN2 (0.56) POLBGAAKDM4EMAPTHTT
SCHEMBL10971632 0.78 CA2 (0.47) POLBGAAALDH1A1PKMMEN1
SCHEMBL9808053 0.78 APP (0.43) POLBGAAKDM4EMAPTHTT
SCHEMBL11214234 0.76 L3MBTL1 (0.48) POLBMAPTALDH1A1PKMMEN1
SCHEMBL11214281 0.76 APEX1 (0.46) KDM4EMAPTALDH1A1MEN1KMT2A
SCHEMBL11218670 0.76 DAO (0.43) MAPTHTTALDH1A1KMT2AANPEP
SCHEMBL6280628 0.75 PTPN1 (0.54) POLBGAAKDM4EMAPTALDH1A1
SCHEMBL9808202 0.75 APP (0.41) POLBGAAKDM4EMAPTHTT
SCHEMBL9808177 0.73 HTT (0.59) POLBGAAKDM4EMAPTHTT

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
US-4329454-A Cephalosporin compounds ELI LILLY AND COMPANY (US) 1982-05-11 US disclosed
US-4144391-A REPLACING AN ACETOXY GROUP BY A SULFUR NUCLEOPHILE ELI LILLY AND COMPANY (US) 1979-03-13 US disclosed