SCHEMBL9944306

SCHEMBL9944306

COCCOc1cc(C(=O)Nc2ccc(C=O)c(F)c2)cc(Cl)c1OC

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.47
TAS1R1 Q7RTX1 1/20 0.47
TAS1R2 Q8TE23 1/20 0.47
MAPT P10636 5/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
NPSR1 Q6W5P4 1/20 0.44
PLAU P00749 3/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42

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
SCHEMBL1458199 0.85 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2MAPTLMNA
SCHEMBL9944289 0.80 PLAU (0.46) TAS1R3TAS1R1TAS1R2MAPTLMNA
SCHEMBL12825327 0.75 MAPT (0.47) MAPTLMNAGAASMN1; SMN2NPC1
SCHEMBL9944353 0.75 TAS1R3 (0.50) TAS1R3TAS1R1TAS1R2MAPTLMNA
SCHEMBL9944303 0.74 MEN1 (0.51) TAS1R3TAS1R1TAS1R2MAPTLMNA
SCHEMBL9944320 0.74 TAS1R3 (0.47) TAS1R3TAS1R1TAS1R2MAPTLMNA
SCHEMBL9944290 0.73 TP53 (0.50) MAPTLMNAGAASMN1; SMN2MEN1
SCHEMBL9944348 0.73 TAS1R3 (0.53) TAS1R3TAS1R1TAS1R2MAPTLMNA
SCHEMBL9944316 0.72 PDE5A (0.47) TAS1R3TAS1R1TAS1R2MAPTLMNA
SCHEMBL9944329 0.72 KCNQ3 (0.46) MAPTLMNAGAASMN1; SMN2NPC1

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-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use KING'S COLLEGE LONDON (GB) 2012-06-14 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-20120149737-A1 Therapeutic Aryl-Amido-Aryl Compounds and Their Use RARA, RARB, RARG TAS1R3 1123/4885TAS1R1 693/4885TAS1R2 808/4885

“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.