SCHEMBL10189394

SCHEMBL10189394

CCC(C)[C@H](N)C(=O)Nc1cc(-c2csnc2-c2cc(C)c(OC)c(OC)c2)ccc1OC

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 1/20 0.39
SUV39H2 Q9H5I1 2/20 0.36
LMNA P02545 2/20 0.35
IARS1 P41252 5/20 0.34
TP53 P04637 2/20 0.34
THRB P10828 1/20 0.34
CIT O14578 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
RXFP1 Q9HBX9 1/20 0.33
ALDH1A1 P00352 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL10189393 1.00 AAK1 (0.39) AAK1SUV39H2LMNAIARS1TP53
SCHEMBL10242331 0.95 AAK1 (0.41) AAK1SUV39H2LMNAIARS1TP53
SCHEMBL10240323 0.95 AAK1 (0.41) AAK1SUV39H2LMNAIARS1TP53
Hydrochloric Acid SCHEMBL624337 0.94 AAK1 (0.41) AAK1SUV39H2LMNAIARS1TP53
SCHEMBL10189395 0.91 LMNA (0.37) AAK1LMNACITMAPTRXFP1
SCHEMBL10189396 0.91 LMNA (0.37) AAK1LMNACITMAPTRXFP1
SCHEMBL10189390 0.91 LMNA (0.39) AAK1SUV39H2LMNACITMAPT
SCHEMBL10189391 0.91 LMNA (0.39) AAK1SUV39H2LMNACITMAPT
SCHEMBL10189378 0.90 LMNA (0.38) AAK1LMNACITMAPTRXFP1
SCHEMBL10241282 0.86 LMNA (0.39) AAK1LMNACITMAPTRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130203824-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS SUN LIJUN (US) 2013-08-08 US disclosed
US-8399435-B2 Compounds for the treatment of proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2013-03-19 US disclosed
US-20120040937-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2012-02-16 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 (2 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-20120040937-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS RB1, MKI67, MAPRE1 AAK1 3020/4885SUV39H2 2439/4885LMNA 2274/4885
US-20130203824-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS RB1, MKI67, MAPRE1 AAK1 3020/4885SUV39H2 2439/4885LMNA 2274/4885

“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.