SCHEMBL21254666

SCHEMBL21254666

CN/C(C)=C(\C=N)C(=O)Nc1ccc(Nc2ccc(NC(=O)c3ccc(N4CCC(O)CC4)cc3)cc2)c(F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.40
▸ LMNA P02545 3/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ RAB9A P51151 7/20 0.39
▸ NPC1 O15118 6/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ TP53 P04637 4/20 0.39
▸ MAPK1 P28482 3/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SLC2A1 P11166 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ KMT2A Q03164 4/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ MCHR1 Q99705 2/20 0.38
▸ MCL1 Q07820 2/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38

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
SCHEMBL21254482 0.90 MAPT (0.39) MAPTLMNARAB9ANPC1SMN1; SMN2
SCHEMBL21254703 0.90 MAPT (0.45) MAPTLMNARAB9ANPC1SMN1; SMN2
SCHEMBL21254465 0.86 RAB9A (0.40) MAPTLMNATDP1RAB9ANPC1
SCHEMBL21254812 0.86 RAB9A (0.40) MAPTLMNATDP1RAB9ANPC1
SCHEMBL21254913 0.86 RAB9A (0.40) MAPTLMNATDP1RAB9ANPC1
SCHEMBL21254918 0.84 MAPT (0.40) MAPTLMNATDP1RAB9ANPC1
SCHEMBL21254472 0.82 RAB9A (0.47) MAPTLMNATDP1RAB9ANPC1
SCHEMBL6120725 0.81 RAB9A (0.51) MAPTLMNATDP1RAB9ANPC1
SCHEMBL21254675 0.81 SLC2A1 (0.47) MAPTLMNATDP1RAB9ANPC1
SCHEMBL1665841 0.80 RAB9A (0.47) MAPTLMNATDP1RAB9ANPC1

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
EP-2488486-B1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARM INC (US) 2019-08-14 — — EP disclosed
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