SCHEMBL4337783

SCHEMBL4337783

C=C(CCCCCCCNC)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4A O75164 1/20 0.47
KDM4C Q9H3R0 1/20 0.47
TBXAS1 P24557 2/20 0.40
ADRA1A P35348 1/20 0.39
EPHX1 P07099 1/20 0.39
PRMT1 Q99873 1/20 0.38
SIGMAR1 Q99720 1/20 0.34
HAO1 Q9UJM8 1/20 0.34
THRB P10828 1/20 0.34
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
PGGT1B P53609 1/20 0.34
PLA2G2A P14555 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
PMP22 Q01453 1/20 0.33
ALOX15 P16050 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PAOX Q6QHF9 1/20 0.33

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
SCHEMBL4334364 1.00 KDM4A (0.47) KDM4AKDM4CTBXAS1ADRA1AEPHX1
SCHEMBL17423957 1.00 KDM4A (0.47) KDM4AKDM4CTBXAS1ADRA1AEPHX1
SCHEMBL637284 0.98 KDM4A (0.44) KDM4AKDM4CTBXAS1ADRA1AEPHX1
SCHEMBL337280 0.91 KDM4A (0.38) KDM4AKDM4CTBXAS1EPHX1ALOX15
Hydrochloric Acid SCHEMBL8005993 0.89 KDM4A (0.41) KDM4AKDM4CTBXAS1EPHX1ALOX15
Chloromethane SCHEMBL1507246 0.88 TET2 (0.36) KDM4AKDM4CTBXAS1LMNAALOX15
SCHEMBL336883 0.82
SCHEMBL15709752 0.82 KDM4C (0.41) KDM4AKDM4CPAOX
SCHEMBL8527958 0.82 KDM4A (0.34) KDM4AKDM4CFNTAFNTBKDM4E
SCHEMBL11122641 0.82 TBXAS1 (0.50) TBXAS1THRBFNTAFNTBPGGT1B

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-20090264551-A1 Photocurable fixture for orthopedic surgery background of the invention ALCARE CO., LTD. 2009-10-22 US disclosed