SCHEMBL2360156

SCHEMBL2360156

CC1(C)CC(O)CC(C)(C(=O)Nc2cc(Cl)cc(Cl)c2)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
GRM4 Q14833 6/20 0.39
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
FABP4 P15090 1/20 0.35
P2RY1 P47900 1/20 0.34

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
SCHEMBL12350998 0.91 GRM4 (0.43) KMT2AMEN1GRM4RAB9A
SCHEMBL12351003 0.88 SLC13A3 (0.43) KMT2AMEN1MAPTSMN1; SMN2
SCHEMBL2359845 0.87 MEN1 (0.47) KMT2AMEN1MAPTNPSR1POLB
SCHEMBL2360096 0.83 EPHX2 (0.34) KMT2AMEN1
SCHEMBL2360243 0.83 EPHX1 (0.45) KMT2AMEN1MAPTPOLBRAB9A
SCHEMBL12351010 0.81 KMT2A (0.42) KMT2AMEN1MAPTPOLBSMN1; SMN2
SCHEMBL2359771 0.80 LMNA (0.44) KMT2AMEN1MAPTPOLBSMN1; SMN2
SCHEMBL12351017 0.80 IDO1 (0.40) MAPT
SCHEMBL2358740 0.78 EPHX2 (0.43) KMT2AMEN1POLBSMN1; SMN2RAB9A
SCHEMBL12351016 0.77 KDR (0.52) KMT2AMEN1GRM4MAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011094953-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 WO disclosed
WO-2011095576-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 WO disclosed
WO-2011095576-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 WO disclosed
US-20110195979-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 US disclosed
US-20110195979-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA F. HOFFMANN-LA ROCHE AG (CH) 2011-08-11 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-20110195979-A1 COMPOUNDS FOR THE TREATMENT AND PREVENTION OF INFLUENZA NAT1, NHERF1, ADORA1 KMT2A 2790/4885MEN1 1215/4885GRM4 3238/4885

“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.