SCHEMBL27601341

SCHEMBL27601341

NC(C=O)Nc1nc(-c2ccc(NC(=O)CN(C(=O)c3ccc(F)cc3)c3ccc4c(c3)OCO4)cc2)cs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.47
▸ LMNA P02545 5/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ HTT P42858 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ TSHR P16473 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ GSTO1 P78417 1/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ ROCK1 Q13464 1/20 0.41
▸ USP2 O75604 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CFTR P13569 5/20 0.39
▸ POLB P06746 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ NFKB2 Q00653 1/20 0.39

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
Hydrochloric Acid SCHEMBL6175614 0.87 MAPT (0.49) MAPTLMNASMN1; SMN2KDM4EHTT
SCHEMBL6176759 0.87 RAB9A (0.57) MAPTLMNASMN1; SMN2KDM4EHTT
SCHEMBL6172214 0.87 MAPT (0.51) MAPTLMNASMN1; SMN2KDM4EHTT
SCHEMBL6174882 0.82 POLB (0.49) MAPTLMNASMN1; SMN2HTTGAA
SCHEMBL27601314 0.80 KMT2A (0.51) MAPTLMNASMN1; SMN2KDM4EHTT
SCHEMBL6174603 0.75 MAPT (0.53) MAPTLMNASMN1; SMN2HTTGAA
Hydrochloric Acid SCHEMBL6173338 0.74 RAB9A (0.50) MAPTLMNASMN1; SMN2KDM4EGAA
SCHEMBL6176630 0.72 RAB9A (0.65) MAPTLMNASMN1; SMN2KDM4EHTT
SCHEMBL6173268 0.72 RAB9A (0.43) MAPTSMN1; SMN2KDM4EGAAALDH1A1
SCHEMBL27601474 0.72 KMT2A (0.41) MAPTLMNASMN1; SMN2KDM4EHTT

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
CN-1473157-A Amide derivatives ֮����ҩ��ʽ���� 2004-02-04 — — CN disclosed
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