SCHEMBL11309845

SCHEMBL11309845

COc1cc(NC(=S)Cc2ccccc2)c(OC)cc1N

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ MAPT P10636 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ RECQL P46063 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ ADORA2A P29274 1/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL11306216 0.90 ALDH1A1 (0.47) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL11309066 0.88 POLB (0.53) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL11689979 0.84 L3MBTL1 (0.48) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11306171 0.84 MEN1 (0.66) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL11311778 0.81 MEN1 (0.52) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL11315258 0.81 RAB9A (0.53) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL4210145 0.76 KMT2A (0.56) MEN1KMT2AHDAC1
SCHEMBL5132500 0.76 HDAC1 (0.52) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL8511541 0.75 HDAC1 (0.49) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL11309038 0.74 MEN1 (0.60) MEN1KMT2AMAPTALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4263205-A FOR COLORING POLYMERS, LACQUERS CIBA-GEIGY CORPORATION (US) 1981-04-21 — — US disclosed
EP-0006154-A1 Monoazo pigments and their use in colouring high molecular-weight organic material CIBA-GEIGY AG (CH) 1980-01-09 — — EP disclosed
US-4062838-A LACQUERS, PRINTING INKS, YELLOW TO ORANGE CIBA-GEIGY CORPORATION (US) 1977-12-13 — — US disclosed
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