SCHEMBL9944288

SCHEMBL9944288

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
NPC1 O15118 2/20 0.49
MAPT P10636 8/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PLAU P00749 1/20 0.46
TP53 P04637 2/20 0.45
GAA P10253 3/20 0.43
ALDH1A1 P00352 4/20 0.42
LMNA P02545 3/20 0.42
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ABL1 P00519 1/20 0.42
RIN1 Q13671 1/20 0.42
TDP1 Q9NUW8 2/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41

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
SCHEMBL9944352 0.91 PLAU (0.44) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL9944331 0.90 RAB9A (0.49) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL9944215 0.86 MEN1 (0.51) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL9944310 0.86 MEN1 (0.50) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL1457823 0.85 KMT2A (0.55) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL9944300 0.85 MAPT (0.49) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL9944336 0.83 TP53 (0.51) KMT2AMAPTPLAUTP53GAA
SCHEMBL9944304 0.82 MAPT (0.50) RAB9AMEN1KMT2ANPC1MAPT
SCHEMBL9944290 0.82 TP53 (0.50) MEN1KMT2AMAPTTP53GAA
SCHEMBL9944214 0.81 MEN1 (0.52) RAB9AMEN1KMT2ANPC1MAPT

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 RAB9A 271/4885MEN1 4809/4885KMT2A 1418/4885

“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.