SCHEMBL20034048

SCHEMBL20034048

C/C=C\c1ccccc1/N=C/c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.45
ALDH1A1 P00352 8/20 0.45
HPGD P15428 5/20 0.45
MAPT P10636 4/20 0.45
LMNA P02545 3/20 0.45
CA2 P00918 5/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
CA12 O43570 3/20 0.40
CA9 Q16790 3/20 0.40
CHAT P28329 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
GAA P10253 3/20 0.37
RAB9A P51151 3/20 0.37
POLB P06746 2/20 0.37
USP2 O75604 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 1/20 0.37
BLM P54132 1/20 0.37
CA1 P00915 4/20 0.36

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
SCHEMBL27830937 0.85 NFE2L2 (0.48) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL8925959 0.81 KDM4E (0.45) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL18820481 0.80 CA12 (0.41) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL12633216 0.77 LMNA (0.59) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL1710167 0.77 LMNA (0.59) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL1870853 0.77 LMNA (0.59) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL15434262 0.77 ALDH1A1 (0.47) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL5963263 0.77 ALDH1A1 (0.51) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL16307970 0.76 ALDH1A1 (0.47) KDM4EALDH1A1HPGDMAPTLMNA
SCHEMBL14045692 0.76 CA12 (0.36) KDM4EALDH1A1HPGDMAPTLMNA

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-9938253-B2 Catalysts for efficient Z-selective metathesis TRUSTEES OF BOSTON COLLEGE (US) 2018-04-10 US disclosed