SCHEMBL19719052

SCHEMBL19719052

O=C(Cc1ccc2c(c1)C1(OC2=O)c2ccc(O)cc2Oc2cc(O)ccc21)NCCCCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 9/20 0.52
▸ HPGD P15428 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ RECQL P46063 1/20 0.52
▸ BLM P54132 1/20 0.52
▸ SMAD3 P84022 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ PRMT1 Q99873 1/20 0.52
▸ ACE2 Q9BYF1 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ ALB P02768 1/20 0.48
▸ NAALAD2 Q9Y3Q0 1/20 0.42
▸ ITPR3 Q14573 1/20 0.40
▸ GSTP1 P09211 1/20 0.40
▸ GLS O94925 1/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ TRPV1 Q8NER1 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
SCHEMBL19835754 0.86 L3MBTL1 (0.48) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL23192580 0.84 ALB (0.51) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL23192497 0.84 ALB (0.51) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL21091701 0.84 FTO (0.45) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL28607477 0.83 FTO (0.53) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL25613623 0.83 ALB (0.54) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL13815243 0.83 FTO (0.58) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL1539101 0.81 FTO (0.63) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL24736621 0.81 FTO (0.45) FTOHPGDMEN1MAPTCYP2C19
SCHEMBL23192496 0.80 FTO (0.62) FTOHPGDMEN1MAPTCYP2C19

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-9846167-B2 Method for detecting and monitoring bone loss LAWSON HEALTH RESEARCH INSTITUTE (CA) 2017-12-19 — — US disclosed
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