SCHEMBL1480944

SCHEMBL1480944

COc1ccc(-c2ccc3c(c2)Cc2ccccc2-3)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
MAPT P10636 5/20 0.56
KDM4E B2RXH2 5/20 0.56
HPGD P15428 3/20 0.56
ABL1 P00519 2/20 0.50
ABCB1 P08183 2/20 0.50
BCR P11274 2/20 0.50
PDK2 Q15119 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CYP3A4 P08684 2/20 0.49
ACHE P22303 1/20 0.49
BACE1 P56817 1/20 0.49
ADORA1 P30542 1/20 0.49
MAPK1 P28482 2/20 0.48
TP53 P04637 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
PKM P14618 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL18932233 0.91 CYP3A4 (0.55) ALDH1A1MAPTKDM4EHPGDABL1
SCHEMBL13358868 0.91 CYP3A4 (0.55) ALDH1A1MAPTKDM4EHPGDABL1
SCHEMBL33722042 0.91 CYP3A4 (0.55) ALDH1A1MAPTKDM4EHPGDABL1
SCHEMBL2914928 0.86 DRD1 (0.58) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL29633762 0.86 DRD1 (0.58) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL1482867 0.84 ACHE (0.45) ALDH1A1MAPTKDM4EHPGDABL1
SCHEMBL3414807 0.84 ALDH1A1 (0.63) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL30395577 0.84 ALDH1A1 (0.63) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL27824487 0.83 MEN1 (0.49) ALDH1A1MAPTKDM4EHPGDPDK2
SCHEMBL3287680 0.82 ALDH1A1 (0.56) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2

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-8293856-B2 Process for preparing olefin polymer using mixed catalyst MITSUI CHEMICALS, INC. (JP) 2012-10-23 US disclosed
US-20110077369-A1 PROCESS FOR PREPARING OLEFIN POLYMER USING MIXED CATALYST MITSU CHEMICALS, INC. 2011-03-31 US disclosed