SCHEMBL9047464

SCHEMBL9047464

COc1ccc(C(=O)C=CC2CCCCC2)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.61
LMNA P02545 3/20 0.61
NPC1 O15118 2/20 0.61
ALDH1A1 P00352 2/20 0.61
USP2 O75604 1/20 0.61
MAPK1 P28482 1/20 0.61
ABCG2 Q9UNQ0 6/20 0.57
TNFRSF1A P19438 2/20 0.53
ABCB1 P08183 2/20 0.53
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
ATM Q13315 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
RAB9A P51151 1/20 0.51
PDE4A P27815 1/20 0.49
PDE4B Q07343 1/20 0.49
PDE4C Q08493 1/20 0.49
PDE4D Q08499 1/20 0.49
ALPL P05186 1/20 0.49
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL424093 0.84 MAPT (0.47) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL424092 0.84 MAPT (0.47) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL13068724 0.80 ABCG2 (0.47) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL15684713 0.75 PDE4B (0.64) LMNANPC1ALDH1A1MEN1KMT2A
SCHEMBL23525751 0.75 PDE4B (0.49) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL30791362 0.75 PDE4B (0.49) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL23525706 0.75 PDE4B (0.49) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL5585560 0.74 ABCG2 (0.69) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL18480639 0.74 ABCG2 (0.69) MAPTLMNANPC1ALDH1A1USP2
SCHEMBL5585542 0.74 ABCG2 (0.69) MAPTLMNANPC1ALDH1A1USP2

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-0339599-B1 Process for producing acylaromatic compounds SUMITOMO CHEMICAL CO (JP) 1996-08-21 EP disclosed
EP-0339599-A2 Process for producing acylaromatic compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-11-02 EP disclosed