SCHEMBL28084086

SCHEMBL28084086

COCCc1ccc(C(N)=O)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
NFKB1 P19838 1/20 0.46
THPO P40225 1/20 0.46
BLM P54132 1/20 0.46
PMP22 Q01453 1/20 0.46
HIF1A Q16665 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
P4HTM Q9NXG6 2/20 0.45
SIRT6 Q8N6T7 1/20 0.44

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
SCHEMBL30404501 0.81 LMNA (0.38) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL29852377 0.79 P4HTM (0.48) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL5044994 0.79 P4HTM (0.54) KMT2AKDM4EMEN1ALDH1A1LMNA
Bupicomide SCHEMBL125601 0.79 NFKB1 (0.73) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL28173335 0.78 KMT2A (0.50) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL28252056 0.78 P4HTM (0.49) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL5755133 0.78 L3MBTL1 (0.49) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL29889518 0.77 CHEK2 (0.48) KMT2AMAPTP4HTMSIRT6OPRM1
SCHEMBL6471165 0.77 KMT2A (0.46) KMT2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL2357414 0.77 ALDH1A1 (0.67) KMT2AKDM4EMEN1ALDH1A1LMNA

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
CN-107207508-A 9H-pyrrolo-bipyridine derivatives UCB生物制药私人有限公司 2017-09-26 CN disclosed
CN-103282363-B Imidazoquinoline derivative and pharmaceutically acceptable salt thereof, preparation method and medical application thereof 上海恒瑞医药有限公司 2016-08-10 CN disclosed