SCHEMBL1766201

SCHEMBL1766201

COc1c(F)cc(C(=O)O)cc1OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.55
MRGPRX4 Q96LA9 6/20 0.54
PTGER1 P34995 2/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
NPC1 O15118 1/20 0.52
HPGD P15428 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SMPD1 P17405 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
BRD4 O60885 1/20 0.49

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
SCHEMBL17191962 0.90 MRGPRX4 (0.58) MRGPRX4PTGER1MEN1KMT2ABRD4
SCHEMBL11762649 0.90 RXRA (0.61) RXRAMRGPRX4MEN1KMT2ANPC1
SCHEMBL1056260 0.90 HPGD (0.61) RXRAMRGPRX4MEN1KMT2ANPC1
SCHEMBL2291970 0.89 MRGPRX4 (0.57) RXRAMRGPRX4PTGER1MEN1KMT2A
SCHEMBL7168025 0.87 RXRA (0.62) RXRAMRGPRX4MEN1KMT2ANPC1
SCHEMBL30102546 0.87 RXRA (0.62) RXRAMRGPRX4MEN1KMT2ANPC1
SCHEMBL15673277 0.85 RXRA (0.62) RXRAMRGPRX4MEN1KMT2ANPC1
SCHEMBL14699807 0.84 RAB9A (0.58) RXRAMRGPRX4PTGER1NPC1RAB9A
SCHEMBL15969027 0.84 MEN1 (0.63) MRGPRX4PTGER1MEN1KMT2AHPGD
SCHEMBL1936167 0.83 MRGPRX4 (0.57) RXRAMRGPRX4PTGER1MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110104055-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES PROTEOTECH INC. 2011-05-05 US disclosed
US-20090060838-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES PROTEOTECH INC. 2009-03-05 US disclosed
US-20090060838-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES PROTEOTECH INC. 2009-03-05 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 (2 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-20090060838-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES IAPP, SNCA, BACE2 RXRA 3906/4885MRGPRX4 3366/4885PTGER1 4307/4885
US-20110104055-A1 SUBSTITUTED N-ARYL BENZAMIDES AND RELATED COMPOUNDS FOR TREATMENT OF AMYLOID DISEASES AND SYNUCLEINOPATHIES IAPP, SNCA, BACE2 RXRA 3731/4885MRGPRX4 3162/4885PTGER1 4212/4885

“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.