SCHEMBL8961777

SCHEMBL8961777

C=C(CC1CCCO1)C(=O)O.C=C(CCCCCC(C)C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
TP53 P04637 1/20 0.41
ALOX12 P18054 1/20 0.41
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.36
USP2 O75604 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4C Q9H3R0 2/20 0.33
KDM4A O75164 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
KMT2A Q03164 1/20 0.32

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
SCHEMBL150652 0.81 ALDH1A1 (0.44) HPGDTP53ALOX12ALDH1A1KDM4E
SCHEMBL138197 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL14936541 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL26700 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL1026046 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL10788708 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL24391 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL8647496 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL920756 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8
SCHEMBL513804 0.78 KDM4C (0.47) ALDH1A1LMNAKDM4CKDM4APHF8

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
EP-0623152-B1 AN ENERGY-POLYMERIZABLE ADHESIVE, COATING, FILM AND PROCESS FOR MAKING THE SAME MINNESOTA MINING & MFG (US) 1996-01-31 EP claimed