SCHEMBL21758069

SCHEMBL21758069

C/C=C/C(=O)Nc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.74
MTNR1B P49286 1/20 0.74
ALDH1A1 P00352 6/20 0.74
TGM2 P21980 1/20 0.67
MAPT P10636 4/20 0.66
LMNA P02545 3/20 0.66
THRB P10828 1/20 0.66
SMN1; SMN2 Q16637 3/20 0.66
POLB P06746 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
LPAR1 Q92633 1/20 0.64
LPAR2 Q9HBW0 1/20 0.64
LPAR3 Q9UBY5 1/20 0.64
HPGD P15428 3/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
KDM4E B2RXH2 1/20 0.61
PKM P14618 1/20 0.61
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60

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
SCHEMBL4740155 0.85 ALDH1A1 (1.00) ALDH1A1TGM2MAPTLMNATHRB
SCHEMBL4740156 0.85 ALDH1A1 (1.00) ALDH1A1TGM2MAPTLMNATHRB
SCHEMBL4147796 0.84 MMP1 (0.63) MTNR1AMTNR1BALDH1A1TGM2MAPT
SCHEMBL19142994 0.84 MMP1 (0.63) MTNR1AMTNR1BALDH1A1TGM2MAPT
SCHEMBL4147799 0.84 MMP1 (0.63) MTNR1AMTNR1BALDH1A1TGM2MAPT
SCHEMBL24262378 0.81 MTNR1A (0.71) MTNR1AMTNR1BALDH1A1TGM2MAPT
SCHEMBL19501011 0.81 SMN1; SMN2 (0.61) MTNR1AMTNR1BALDH1A1TGM2MAPT
SCHEMBL262594 0.81 MAPT (0.59) MTNR1AMTNR1BALDH1A1TGM2MAPT
SCHEMBL262593 0.81 MAPT (0.59) MTNR1AMTNR1BALDH1A1TGM2MAPT
SCHEMBL9017578 0.80 TGM2 (1.00) ALDH1A1TGM2MAPTLMNATHRB

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-20200062696-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200062696-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 RTN4, RTN3, RCN1 MTNR1A 4352/4885MTNR1B 4359/4885ALDH1A1 4014/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.