SCHEMBL27396160

SCHEMBL27396160

CCC(=O)Oc1c(-c2ccccc2)c2cc(OC)c(OC)cc2n(C)c1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.41
▸ TACR1 P25103 4/20 0.40
▸ PDE3B Q13370 1/20 0.40
▸ PDE3A Q14432 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ TP53 P04637 1/20 0.39
▸ PADI4 Q9UM07 1/20 0.39
▸ BRPF1 P55201 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ PDE10A Q9Y233 1/20 0.38
▸ EDNRB P24530 1/20 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
SCHEMBL27418174 0.83 HDAC6 (0.55) HDAC6LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL27394945 0.82 DPP4 (0.46) HDAC6LMNAKMT2ASMN1; SMN2MAPT
SCHEMBL8784910 0.78 TSHR (0.56) LMNAKMT2ASMN1; SMN2MAPTPADI4
SCHEMBL9588260 0.72 KDM4E (0.59) LMNAKMT2ASMN1; SMN2TSHR
SCHEMBL4766620 0.70 EDNRB (0.51) TACR1KMT2AMAPTTSHREDNRB
SCHEMBL27397727 0.70 KDM4E (0.40) LMNAKMT2ASMN1; SMN2MAPTTP53
SCHEMBL19661320 0.70 TSHR (0.44) LMNASMN1; SMN2MAPTTP53TSHR
SCHEMBL4764285 0.69 EDNRB (0.53) KMT2AMAPTTP53TSHRPDE10A
SCHEMBL10490954 0.67 KMT2A (0.40) LMNAKMT2ASMN1; SMN2MAPTTP53
SCHEMBL9628751 0.66 MEN1 (0.42) LMNAKMT2ASMN1; SMN2MAPTTSHR

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-1090274-A Condensed heterocyclic compounds and its preparation method and application TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-08-03 — — CN disclosed
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