SCHEMBL177124

SCHEMBL177124

Cc1c(N)cccc1O[PH](=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
CYP3A4 P08684 2/20 0.46
PIK3CA P42336 1/20 0.46
ALDH1A1 P00352 6/20 0.39
TDP1 Q9NUW8 2/20 0.36
ADRA2B P18089 1/20 0.36
PTGS1 P23219 1/20 0.36
GAA P10253 1/20 0.35
ACHE P22303 1/20 0.34
MAPT P10636 2/20 0.33
CD44 P16070 1/20 0.33
HSD17B10 Q99714 3/20 0.33
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
MCL1 Q07820 1/20 0.32
CFTR P13569 1/20 0.32

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
SCHEMBL545054 0.81 MAPT (0.47) ALDH1A1TDP1GAAMAPTMEN1
SCHEMBL4097610 0.80 ALDH1A1 (0.46) TSHRCYP3A4ALDH1A1TDP1ADRA2B
SCHEMBL8174091 0.73 CYP3A4 (0.62) TSHRCYP3A4PIK3CAALDH1A1TDP1
SCHEMBL907658 0.73 ACHE (0.61) TSHRCYP3A4PIK3CAALDH1A1TDP1
SCHEMBL176878 0.73 TDP1 (0.56) TSHRALDH1A1TDP1GAAHSD17B10
SCHEMBL176880 0.73 TDP1 (0.56) TSHRALDH1A1TDP1GAAHSD17B10
SCHEMBL30716857 0.73 CA1 (0.35) TSHRALDH1A1TDP1PTGS1GAA
SCHEMBL4451596 0.72 TSHR (0.41) TSHRTDP1ACHEMAPTKDM4E
SCHEMBL13394018 0.71 CYP3A4 (0.59) TSHRCYP3A4PIK3CAALDH1A1TDP1
SCHEMBL265737 0.71 ALDH1A1 (0.62) TSHRCYP3A4PIK3CAALDH1A1TDP1

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
US-20110251418-A1 CASR AGONISTS AJINOMOTO CO., INC. (JP) 2011-10-13 US disclosed
EP-2345636-A1 CASR AGONIST Ajinomoto Co., Inc. (JP) 2011-07-20 EP 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-20110251418-A1 CASR AGONISTS CASR, GIPR, GRIK5 TSHR 481/4885CYP3A4 3376/4885PIK3CA 1043/4885

“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.