SCHEMBL6916141

SCHEMBL6916141

C/C(=N\c1ccccc1)c1cc(C)cc(/C(C)=N/c2c(C(C)C)cccc2C(C)C)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.34
LMNA P02545 4/20 0.34
MEN1 O00255 3/20 0.34
MAPT P10636 3/20 0.34
RAB9A P51151 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
IDE P14735 1/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
GABRA1 P14867 3/20 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
SCHEMBL6916144 1.00 KMT2A (0.34) KMT2ALMNAMEN1MAPTRAB9A
SCHEMBL6907816 0.92 GABRA1 (0.37) KMT2ALMNAGABRA1GABRG2GABRB3
SCHEMBL6907820 0.92 GABRA1 (0.37) KMT2ALMNAGABRA1GABRG2GABRB3
SCHEMBL6912475 0.90 NOS3 (0.33) KMT2ALMNAMEN1MAPTRAB9A
Hydrochloric Acid SCHEMBL7173893 0.89 GABRA1 (0.35) LMNAGABRA1GABRG2GABRB3HIF1A
Hydrochloric Acid SCHEMBL7180395 0.89 GABRA1 (0.35) LMNAGABRA1GABRG2GABRB3HIF1A
Hydrochloric Acid SCHEMBL7176069 0.89 GABRA1 (0.35) LMNAGABRA1GABRG2GABRB3HIF1A
Hydrochloric Acid SCHEMBL7178078 0.89 GABRA1 (0.35) LMNAGABRA1GABRG2GABRB3HIF1A
Hydrochloric Acid SCHEMBL7173240 0.89 GABRA1 (0.35) LMNAGABRA1GABRG2GABRB3HIF1A
Hydrochloric Acid SCHEMBL7177858 0.89 GABRA1 (0.35) LMNAGABRA1GABRG2GABRB3HIF1A

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
WO-2004074333-A2 PROCESS FOR HOMO- OR COPOLYMERIZATIONOF CONJUGATED OLEFINES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-09-02 WO disclosed