SCHEMBL7754967

SCHEMBL7754967

CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)CC(O)CC

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
MAPK1 P28482 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
DNM1 Q05193 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PLA2G1B P04054 1/20 0.39
PLA2G2A P14555 1/20 0.39
GGPS1 O95749 3/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL7759658 1.00 KDM4E (0.42) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL31392950 1.00 KDM4E (0.42) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL7759989 1.00 KDM4E (0.42) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL7759990 1.00 KDM4E (0.42) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL11698298 1.00 KDM4E (0.42) KDM4EMAPK1TDP1DNM1MEN1
Hydrochloric Acid SCHEMBL3625622 0.98 DNM1 (0.43) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL11699013 0.98 KDM4E (0.44) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL7758914 0.96 DNM1 (0.41) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL7759974 0.96 DNM1 (0.41) KDM4EMAPK1TDP1DNM1MEN1
SCHEMBL7759981 0.96 DNM1 (0.41) KDM4EMAPK1TDP1DNM1MEN1

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
US-6329327-B1 MOLYBDENUM AMINE COMPOUND FORMED BY REACTION OF HEXAVALENT MOLYBDENUM WITH AMINE ASAHI DENKA KOGYO, K.K. (JP) 2001-12-11 US disclosed
EP-1088882-A1 Lubricating compositions comprising a molybdenum-containing amine compound ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 2001-04-04 EP disclosed