SCHEMBL8086291

SCHEMBL8086291

OC(CCBr)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.34
MEN1 O00255 1/20 0.34
TTR P02766 1/20 0.34
KMT2A Q03164 1/20 0.34
GRIN1 Q05586 4/20 0.34
GRIN2A Q12879 4/20 0.34
GRIN2D O15399 3/20 0.34
GRIN2C Q14957 3/20 0.34
GRIN2B Q13224 2/20 0.34
CYP2C19 P33261 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
RIPK1 Q13546 1/20 0.33
ALDH1A1 P00352 3/20 0.32
CYP2D6 P10635 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
MAPK1 P28482 1/20 0.32

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
Chlorotriphenylmethane SCHEMBL8711570 0.91 CNR1 (0.36) KIF11MEN1TTRKMT2AGRIN1
SCHEMBL8659893 0.81 TRPA1 (0.37) KIF11MEN1TTRKMT2AGRIN1
SCHEMBL10770500 0.79 MEN1 (0.38) KIF11MEN1TTRKMT2AGRIN1
SCHEMBL8660267 0.76 THRB (0.34) KIF11MEN1TTRKMT2AGRIN1
SCHEMBL3399635 0.76 CPA3 (0.49) KIF11CYP2C19CYP1A2ALDH1A1CYP2D6
SCHEMBL914102 0.75 KDM4E (0.39) KIF11TDP1KDM4ELMNAMAPK1
SCHEMBL11290864 0.75 KDM4E (0.33) KIF11MEN1TTRKMT2AGRIN1
SCHEMBL17396368 0.74 CPA3 (0.39) GRIN1GRIN2AGRIN2DGRIN2CGRIN2B
SCHEMBL6655136 0.74 TAAR1 (0.41) KIF11KDM4ELMNAMAPK1KCNN4
SCHEMBL34051 0.73 FOLH1 (0.43) MEN1TTRKMT2ACYP2C19ALDH1A1

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
US-6133452-A REACTION OF OPTIONALLY SUBSTITUTED INDOLE-3-ACETAMIDES WITH OPTIONALLY SUBSTITUTED METHYL INDOLE-3-GLYOXYL REAGENT TO PREPARE POTENT PKC INHIBITORS ELI LILLY AND COMPANY (US) 2000-10-17 US disclosed
US-5990319-A REACTING INDOLYL-3-ACETAMIDE WITH INDOLYL-3-GLYOXYL REAGENT ELI LILLY AND COMPANY (US) 1999-11-23 US disclosed
US-5948907-A DEPROTONATION OF THE CORRESPONDING AMIDE COMPOUND WITH A STRONG BASE ELI LILLY AND COMPANY (US) 1999-09-07 US disclosed
EP-0825190-A1 Synthesis of bisindolymaleimides ELI LILLY AND COMPANY (US) 1998-02-25 EP disclosed