SCHEMBL9704213

SCHEMBL9704213

COc1ccc(-c2cc(C)cc(-c3ccc(OC)cc3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.60
KDR P35968 1/20 0.60
DYRK1A Q13627 1/20 0.58
NPC1 O15118 7/20 0.57
RAB9A P51151 7/20 0.57
KDM4E B2RXH2 7/20 0.57
PKM P14618 2/20 0.57
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
ALDH1A3 P47895 2/20 0.54
ALDH1A1 P00352 3/20 0.54
HPGD P15428 3/20 0.54
MAPT P10636 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
CASP3 P42574 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
ENPP3 O14638 1/20 0.53
ATM Q13315 1/20 0.53
ACACA Q13085 1/20 0.51
LMNA P02545 1/20 0.51

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
SCHEMBL7859483 0.85 ADORA3 (0.61) EGFRKDRDYRK1ANPC1RAB9A
SCHEMBL3237986 0.83 EGFR (0.60) EGFRKDRDYRK1ANPC1RAB9A
SCHEMBL31326814 0.83 EGFR (0.60) EGFRKDRDYRK1ANPC1RAB9A
SCHEMBL8271638 0.80 ACACA (0.66) DYRK1ANPC1RAB9AKDM4EMEN1
SCHEMBL28342829 0.80 ACHE (0.58) EGFRKDRNPC1RAB9AKDM4E
SCHEMBL12264964 0.80 MEN1 (0.55) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL12306221 0.79 ADORA3 (0.59) EGFRKDRDYRK1ANPC1RAB9A
SCHEMBL28196806 0.79 ACACA (0.64) NPC1RAB9AKDM4EMEN1KMT2A
SCHEMBL9619331 0.79 KDM4E (0.54) EGFRKDRDYRK1ANPC1RAB9A
SCHEMBL4347032 0.79 ACACA (0.64) NPC1RAB9AKDM4EMEN1KMT2A

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
EP-0463492-A1 2,6-Diarylpyridin derivatives BAYER AG (DE) 1992-01-02 EP claimed
EP-0463492-A1 2,6-Diarylpyridin derivatives BAYER AG (DE) 1992-01-02 EP disclosed