SCHEMBL7183892

SCHEMBL7183892

OC1c2ccccc2-c2cccc(-c3ccccc3Br)c21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 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
SCHEMBL20123183 0.90 ALDH1A1 (0.39) ALDH1A1MAPK1KDM4EMEN1TP53
SCHEMBL15904247 0.78 KDM4E (0.39) ALDH1A1KDM4EMEN1TP53CYP3A4
SCHEMBL7324096 0.78 CHRNB2 (0.45) ALDH1A1MAPK1KDM4EMEN1TP53
SCHEMBL28456656 0.78 HTR2B (0.40) ALDH1A1MAPK1KDM4EMEN1TP53
SCHEMBL27935289 0.77 ALDH1A1 (0.50) ALDH1A1KDM4EMEN1TP53CYP3A4
SCHEMBL9122691 0.77 KDM1A (0.40) ALDH1A1MAPK1MEN1KMT2AHSD17B10
SCHEMBL11783880 0.76 HTR2B (0.51) ALDH1A1KDM4EMEN1TP53CYP3A4
SCHEMBL1261847 0.76 MEN1 (0.45) ALDH1A1KDM4EMEN1TP53CYP3A4
SCHEMBL18456445 0.74 KDM4E (0.39) ALDH1A1KDM4EMEN1TP53CYP3A4
SCHEMBL28865931 0.74 PPIA (0.46) ALDH1A1KDM4EMEN1TP53CYP3A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1059299-B1 Process for the polymerisation of olefins in the presence of indenyl compounds SABIC POLYPROPYLENES BV (NL) 2003-12-17 EP disclosed
US-6342622-B1 COMPOUNDS HAVING BRIDGING GROUP CONTAINING AT LEAST ONE SP2-HYBRIDISED CARBON ATOM BONDED TO INDENYL GROUP AT 2-POSITION ARE MORE ACTIVE AND/OR GIVE POLYMERS WITH HIGHER MOLECULAR WEIGHT DSM B.V. (NL) 2002-01-29 US disclosed
EP-1059299-A1 Indenyl compounds for the polymerisation of olefins DSM N.V. (NL) 2000-12-13 EP disclosed
EP-1059300-A1 Indenyl compounds for the polymerisation of olefins DSM N.V. (NL) 2000-12-13 EP disclosed