SCHEMBL8710264

SCHEMBL8710264

CCOC(=O)C1(C(=O)Cc2c(C)cc(C)cc2C)CC(OC)C(OC)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPK1 P28482 1/20 0.32
NLRP3 Q96P20 1/20 0.32
P2RX7 Q99572 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31
TUBB4B P68371 1/20 0.31
TUBB3 Q13509 1/20 0.31
TUBB2A Q13885 1/20 0.31
TUBB8 Q3ZCM7 1/20 0.31
TUBA3E Q6PEY2 1/20 0.31
TUBA1A Q71U36 1/20 0.31
TUBA1C Q9BQE3 1/20 0.31
TUBB6 Q9BUF5 1/20 0.31
TUBB2B Q9BVA1 1/20 0.31

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
SCHEMBL8705329 0.87 L3MBTL1 (0.35) MEN1KMT2AMAPK1NLRP3SMN1; SMN2
SCHEMBL8704137 0.87 MEN1 (0.33) MEN1KMT2AMAPK1NLRP3P2RX7
SCHEMBL8707386 0.85 MAPT (0.31) P2RX7
SCHEMBL8703631 0.84 MEN1 (0.33) MEN1KMT2AMAPK1NLRP3P2RX7
SCHEMBL8704313 0.84 MEN1 (0.33) MEN1KMT2AMAPK1NLRP3P2RX7
SCHEMBL8708095 0.82 SMN1; SMN2 (0.37) MEN1KMT2AMAPK1NLRP3SMN1; SMN2
SCHEMBL8703912 0.82 SMN1; SMN2 (0.40) MEN1KMT2AMAPK1NLRP3SMN1; SMN2
SCHEMBL8704072 0.82 ALDH1A1 (0.33) MEN1KMT2AMAPK1SMN1; SMN2L3MBTL1
SCHEMBL8709123 0.82 OPRM1 (0.33) MEN1KMT2AMAPK1NLRP3P2RX7
SCHEMBL8707703 0.81 KDM4E (0.34) MEN1KMT2AMAPK1NLRP3P2RX7

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5808135-A HERBICIDE; PESTICIDE BAYER AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed