SCHEMBL9944303

SCHEMBL9944303

CCOc1c(Cl)cc(C(=O)Nc2ccc(C=O)c(C)c2)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MAPT P10636 9/20 0.49
NPSR1 Q6W5P4 1/20 0.49
LMNA P02545 2/20 0.47
GAA P10253 2/20 0.47
THRB P10828 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
TP53 P04637 3/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45

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
SCHEMBL9944331 0.90 RAB9A (0.49) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944354 0.87 MAPT (0.49) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944340 0.87 MAPT (0.47) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944304 0.86 MAPT (0.50) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944220 0.85 MAPT (0.53) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944293 0.85 TAS1R3 (0.53) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL1458380 0.84 MEN1 (0.57) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944302 0.84 MEN1 (0.49) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944320 0.83 TAS1R3 (0.47) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL9944277 0.83 MAPT (0.51) MEN1KMT2ANPC1RAB9AMAPT

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 MEN1 4809/4885KMT2A 1418/4885NPC1 277/4885

“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.