SCHEMBL11214201

SCHEMBL11214201

CCOc1cccc(N(C(=O)CC(C)=O)C(=O)CC(C)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 4/20 0.47
▸ MAPK1 P28482 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ MTNR1A P48039 6/20 0.45
▸ MTNR1B P49286 6/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ RXRA P19793 1/20 0.44
▸ RXRB P28702 1/20 0.44
▸ HTT P42858 2/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ NR1H4 Q96RI1 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C19 P33261 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
SCHEMBL11206968 0.86 MTNR1B (0.56) MTNR1AMTNR1B
SCHEMBL11210194 0.78 CRHBP (0.44) MAPK1MAPTSMN1; SMN2KMT2AHPGD
SCHEMBL9505366 0.78 ALDH1A1 (0.46) LMNAALDH1A1SMN1; SMN2KMT2AHTT
SCHEMBL15266769 0.77 ALDH1A1 (0.48) LMNAMAPK1ALDH1A1L3MBTL1MAPT
SCHEMBL11429495 0.76 MAPT (0.44) LMNAALDH1A1L3MBTL1MAPTSMN1; SMN2
SCHEMBL11596353 0.75 KDM4E (0.50) LMNAALDH1A1L3MBTL1MAPTSMN1; SMN2
SCHEMBL11524158 0.75 TP53 (0.57) LMNAMAPK1ALDH1A1L3MBTL1MAPT
SCHEMBL9411919 0.75 MTNR1A (0.46) LMNAALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL59241 0.73 APP (0.58) LMNAMAPK1ALDH1A1L3MBTL1MAPT
SCHEMBL26624253 0.73 MTNR1A (0.53) MTNR1AMTNR1B

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
EP-0025164-B1 DISAZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND USE HOECHST AKTIENGESELLSCHAFT (DE) 1983-04-13 — — EP disclosed
EP-0025164-A1 Disazo compounds, process for their preparation and use HOECHST AKTIENGESELLSCHAFT (DE) 1981-03-18 — — EP disclosed
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