SCHEMBL11654042

SCHEMBL11654042

CCOC(=O)C(C)(C)Nc1cccc(NC(C)=O)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ POLB P06746 2/20 0.54
▸ RAB9A P51151 2/20 0.54
▸ NR4A1 P22736 1/20 0.54
▸ HSD17B10 Q99714 3/20 0.50
▸ MAPT P10636 3/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ LMNA P02545 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46

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
SCHEMBL2986775 0.81 MAPT (0.56) POLBRAB9AHSD17B10MAPTLMNA
SCHEMBL10294089 0.80 RAB9A (0.64) MEN1KMT2APOLBRAB9ANR4A1
SCHEMBL2655256 0.78 PPARA (0.56) MEN1KMT2APOLBRAB9ANR4A1
SCHEMBL11656857 0.78 ALDH1A1 (0.47) MEN1KMT2APOLBMAPTL3MBTL1
SCHEMBL13996533 0.78 RAB9A (0.61) MEN1KMT2APOLBRAB9ANR4A1
SCHEMBL20839774 0.77 ALDH1A1 (0.60) MEN1KMT2APOLBRAB9AMAPT
SCHEMBL11729043 0.75 MAPT (0.45) MEN1KMT2ARAB9AMAPTL3MBTL1
SCHEMBL28829520 0.75 L3MBTL1 (0.55) MEN1KMT2APOLBRAB9ANR4A1
SCHEMBL1901172 0.74 ALDH1A1 (0.76) MEN1KMT2APOLBRAB9ANR4A1
SCHEMBL2945233 0.74 ALDH1A1 (0.50) MEN1KMT2APOLBMAPTL3MBTL1

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-4087420-A DYEING AND PRINTING OF HYDROPHOBIC SYNTHETIC FIBERS AND FILMS CASSELLA FARBWERKE MAINKUR AKTIENGESELLSCHAFT (DT) 1978-05-02 — — US disclosed
US-4035143-A HYDROPHOBIC FIBERS AND FILMS, HETEROAROMATIC RADICALS CASSELLA FARBWERKE MAINKUR AKTIENGESELLSCHAFT (DT) 1977-07-12 — — US disclosed
Send feedback