SCHEMBL28446135

SCHEMBL28446135

O=C(O)CNC(=O)c1cnc(NCc2ccc(-c3ccccc3)cc2)nc1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.53
▸ HDAC1 Q13547 1/20 0.53
▸ HDAC2 Q92769 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ EGLN1 Q9GZT9 11/20 0.47
▸ FLT3 P36888 1/20 0.46
▸ TYRO3 Q06418 1/20 0.46
▸ MERTK Q12866 1/20 0.46
▸ GAS6 Q14393 1/20 0.46
▸ EGLN3 Q9H6Z9 1/20 0.45
▸ RAB9A P51151 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ KDM5B Q9UGL1 2/20 0.44
▸ KDM4C Q9H3R0 1/20 0.44
▸ STAT6 P42226 1/20 0.43
▸ EPHX2 P34913 1/20 0.43
▸ NR1H4 Q96RI1 1/20 0.43
▸ FFAR1 O14842 1/20 0.43
▸ GALR3 O60755 1/20 0.43
▸ NR2F2 P24468 1/20 0.43

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
SCHEMBL30345445 1.00 HDAC3 (0.53) HDAC3HDAC1HDAC2HDAC6EGLN1
SCHEMBL30345304 0.88 EGLN1 (0.50) EGLN1RAB9ANPSR1KDM4CFFAR1
SCHEMBL28897243 0.88 EGLN1 (0.50) EGLN1RAB9ANPSR1KDM4CFFAR1
SCHEMBL30345395 0.87 HDAC3 (0.50) HDAC3HDAC1HDAC2HDAC6EGLN1
SCHEMBL28448361 0.87 HDAC3 (0.50) HDAC3HDAC1HDAC2HDAC6EGLN1
SCHEMBL28441539 0.84 DGAT1 (0.49) HDAC1EGLN1EGLN3RAB9AKDM5B
SCHEMBL28442501 0.82 EGLN1 (0.64) EGLN1EGLN3
SCHEMBL30345480 0.82 EGLN1 (0.64) EGLN1EGLN3
SCHEMBL10493046 0.77 ATM (0.59) HDAC3HDAC1HDAC2HDAC6RAB9A
SCHEMBL28449008 0.74 EGLN1 (0.48) EGLN1EPHX2FTO

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-111559982-A 2- (2-substituted-4-hydroxypyrimidine-5-formamido) acetic acid compound and preparation method and application thereof 天津市医药科学研究所 2020-08-21 — — CN claimed
CN-111559982-A 2- (2-substituted-4-hydroxypyrimidine-5-formamido) acetic acid compound and preparation method and application thereof 天津市医药科学研究所 2020-08-21 — — CN disclosed
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