SCHEMBL11297752

SCHEMBL11297752

OC1=C(C2CCCCC2)CCCC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NUDT1 P36639 1/20 0.31
BACE1 P56817 1/20 0.31
KMT2A Q03164 1/20 0.30

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
SCHEMBL27714283 0.97 KDM4E (0.37) KDM4EPOLBL3MBTL1
Methyl Alcohol SCHEMBL16238245 0.95 KDM4E (0.33) KDM4EPOLBL3MBTL1KMT2A
SCHEMBL10598394 0.82
SCHEMBL59379 0.81 KDM4E (0.37) KDM4EPOLBL3MBTL1KMT2A
Ethane SCHEMBL28079163 0.76 KMT2A (0.39) KDM4EPOLBL3MBTL1KMT2A
SCHEMBL28614043 0.73 KDM4E (0.36) KDM4EPOLBL3MBTL1
SCHEMBL11739358 0.73 KDM4E (0.36) KDM4EPOLBL3MBTL1
SCHEMBL751060 0.72 KDM4E (0.31) KDM4EPOLBL3MBTL1
SCHEMBL751189 0.70 KDM4E (0.32) KDM4EPOLBL3MBTL1
SCHEMBL28078405 0.70 KDM4E (0.45) KDM4EPOLBL3MBTL1KMT2A

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-0008013-B1 PROCESS FOR THE PREPARATION OF CARBONYL COMPOUNDS BASF Aktiengesellschaft (DE) 1982-02-17 EP disclosed
EP-0008013-A1 Process for the preparation of carbonyl compounds BASF Aktiengesellschaft (DE) 1980-02-20 EP disclosed