SCHEMBL19519708

SCHEMBL19519708

C=NCC1OB(O)c2c(OC)cccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LARS1 Q9P2J5 5/20 0.43
▸ TP53 P04637 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ ALOX12 P18054 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HTR2A P28223 1/20 0.31
▸ HTR2C P28335 1/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ NR3C1 P04150 1/20 0.31
▸ GAA P10253 1/20 0.31

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
SCHEMBL12831366 0.83 LARS1 (0.60) LARS1HTR2AHTR2CHTR2B
SCHEMBL16256484 0.83 LARS1 (0.47) LARS1TP53KDM4EALDH1A1MAPT
SCHEMBL13035602 0.83 LARS1 (0.60) LARS1HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL3446383 0.82 LARS1 (0.61) LARS1HTR2AHTR2CHTR2B
SCHEMBL20482071 0.78 LARS1 (0.43) LARS1
SCHEMBL20481923 0.78 LARS1 (0.43) LARS1TP53KDM4EALDH1A1MAPT
SCHEMBL20481959 0.78 LARS1 (0.43) LARS1TP53KDM4EALDH1A1MAPT
SCHEMBL20481916 0.77 LARS1 (0.42) LARS1TP53KDM4EALDH1A1MAPT
SCHEMBL3446061 0.76 LARS1 (0.41) LARS1TP53KDM4EALDH1A1MAPT
SCHEMBL20481966 0.76 LARS1 (0.41) LARS1LMNAALOX15

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
US-9796735-B2 Boron-containing small molecules ANACOR PHARMACEUTICALS, INC. (US) 2017-10-24 — — US disclosed
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