SCHEMBL27795128

SCHEMBL27795128

N#Cc1cc(C(=O)C2CC2)n2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.46
▸ LMNA P02545 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ELANE P08246 4/20 0.40
▸ HSD11B1 P28845 1/20 0.38
▸ BAZ2B Q9UIF8 6/20 0.37
▸ BAZ2A Q9UIF9 6/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ FNTA P49354 1/20 0.37
▸ FNTB P49356 1/20 0.37
▸ RIPK1 Q13546 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL17339134 0.81 FNTA (0.48) LMNATSHRBAZ2BBAZ2AKDM4E
SCHEMBL5259049 0.77 FNTA (0.62) BAZ2BBAZ2AFNTAFNTBHTT
SCHEMBL27696466 0.73 ALDH1A1 (0.40) TSHRBAZ2BBAZ2AKDM4EALDH1A1
SCHEMBL17339104 0.73 KDM4E (0.52) SMN1; SMN2ELANEKDM4EALDH1A1GAA
SCHEMBL27746851 0.67 ALDH1A1 (0.41) LMNATSHRSMN1; SMN2KDM4EALDH1A1
SCHEMBL1778700 0.67 KDM4E (0.49) LMNATSHRKDM4EALDH1A1GAA
SCHEMBL543429 0.66 RORC (0.40) —
SCHEMBL27767828 0.65 MAOA (0.46) LMNASMN1; SMN2KDM4EALDH1A1GAA
SCHEMBL10123875 0.64 RORC (0.48) —
SCHEMBL7441083 0.64 ALDH1A1 (0.42) LMNATSHRSMN1; SMN2KDM4EALDH1A1

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-101659663-B Indolizine derivative as well as preparation method and application thereof UNIV SHAOXING 2011-06-08 — — CN disclosed
CN-101659663-A Indolizine derivative as well as preparation method and application thereof UNIV SHAOXING 2010-03-03 — — CN disclosed
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