SCHEMBL7960902

SCHEMBL7960902

COC(=O)C1(NC(=O)Cc2c(C)cc(C)cc2OC)CCCCCC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALPL P05186 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LPAR1 Q92633 1/20 0.35
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL7960239 1.00 MAPT (0.38) MAPTALDH1A1L3MBTL1ALPLNPC1
SCHEMBL7949834 1.00 MAPT (0.38) MAPTALDH1A1L3MBTL1ALPLNPC1
SCHEMBL7961784 0.99 MAPT (0.36) MAPTALDH1A1L3MBTL1ALPLLPAR1
SCHEMBL9595748 0.91 MAPT (0.42) MAPTALDH1A1L3MBTL1
SCHEMBL7964416 0.91 LPAR1 (0.42) MAPTLPAR1
SCHEMBL7960411 0.91 LPAR1 (0.42) MAPTLPAR1
SCHEMBL7960118 0.91 LPAR1 (0.42) MAPTLPAR1
SCHEMBL9595918 0.90 MAPT (0.40) MAPTALDH1A1L3MBTL1
SCHEMBL7961794 0.89 LPAR1 (0.41) LPAR1
SCHEMBL7949977 0.87 GAA (0.37) MAPTALDH1A1NPC1RAB9ALPAR1

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-6172255-B1 INSECTICIDES; MITICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-01-09 US disclosed
US-5830826-A Alkoxy-alkyl-substituted 1H-3-aryl-pyrrolidine-2, 4-diones used as herbicicides and pesticides BAYER AKTIENGESELLSCHAFT (DE) 1998-11-03 US disclosed