SCHEMBL10189440

SCHEMBL10189440

COc1ccc(-c2csnc2-c2cc(C)c(OC)c(OC)c2)cc1NC(=O)[C@@H](N)CCCNC(=N)N

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.33
MAPT P10636 3/20 0.33
CIT O14578 1/20 0.33
RXFP1 Q9HBX9 2/20 0.32
NPY4R P50391 2/20 0.32
NPY1R P25929 1/20 0.32
PRKCZ Q05513 1/20 0.31
AAK1 Q2M2I8 4/20 0.31
POLB P06746 2/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
CASR P41180 1/20 0.31

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
SCHEMBL10189438 1.00 LMNA (0.33) LMNAMAPTCITRXFP1NPY4R
SCHEMBL10242326 0.95 CIT (0.34) LMNAMAPTCITRXFP1NPY4R
SCHEMBL10240762 0.95 CIT (0.34) LMNAMAPTCITRXFP1NPY4R
Hydrochloric Acid SCHEMBL624607 0.95 CIT (0.34) LMNAMAPTCITRXFP1NPY4R
SCHEMBL10189437 0.88 SUV39H2 (0.38) LMNACITRXFP1AAK1
SCHEMBL10189436 0.88 SUV39H2 (0.38) LMNACITRXFP1AAK1
SCHEMBL10189431 0.88 CIT (0.35) LMNAMAPTCITRXFP1PRKCZ
SCHEMBL10189430 0.88 CIT (0.35) LMNAMAPTCITRXFP1PRKCZ
SCHEMBL15159131 0.87 ITGB3 (0.30)
SCHEMBL15159135 0.87 ITGB3 (0.30)

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 LMNA 2274/4885MAPT 95/4885CIT 337/4885
US-20130203824-A1 COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS RB1, MKI67, MAPRE1 LMNA 2274/4885MAPT 95/4885CIT 337/4885

“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.