SCHEMBL440962

SCHEMBL440962

CN(NC(=O)OC(C)(C)C)C(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.49
POLB P06746 1/20 0.47
CTSL P07711 2/20 0.47
CTSB P07858 2/20 0.47
CTSS P25774 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP3A4 P08684 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
SCHEMBL25571221 0.86 PPARG (0.41) AKT1CTSLCTSBCTSSNPC1
SCHEMBL25571225 0.84 RECQL (0.40) AKT1CTSLCTSBCTSSMEN1
SCHEMBL1644251 0.84 HSP90AA1 (0.60) AKT1POLBCTSLCTSBCTSS
SCHEMBL25571223 0.84 ABCB1 (0.48) SMN1; SMN2MEN1KMT2ATDP1CYP3A4
SCHEMBL25571222 0.83 HTT (0.50) KMT2ACA1ALDH1A1HSD17B10TDP1
SCHEMBL25244239 0.83 CES2 (0.42) CTSSMEN1NPC1RAB9AKMT2A
SCHEMBL25571227 0.83 KMT2A (0.49) AKT1POLBSMN1; SMN2NPC1RAB9A
SCHEMBL8173651 0.83 POLB (0.67) AKT1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL4514673 0.83 AKT1 (0.48) AKT1POLBCTSLCTSBCTSS
SCHEMBL25571224 0.82 ABCB1 (0.49) SMN1; SMN2MEN1NPC1GAARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8907131-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2014-12-09 US disclosed
US-8907131-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2014-12-09 US disclosed
US-20140342999-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2014-11-20 US disclosed
US-20140342999-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2014-11-20 US disclosed
US-8729111-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2014-05-20 US disclosed
US-8729111-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2014-05-20 US disclosed
US-20140031429-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS KOYA KEIZO (US) 2014-01-30 US disclosed
US-20140031429-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS KOYA KEIZO (US) 2014-01-30 US disclosed
US-8455686-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2013-06-04 US disclosed
US-8455686-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2013-06-04 US disclosed
US-20120095103-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2012-04-19 US disclosed
US-20120095103-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. (US) 2012-04-19 US disclosed
US-20120065235-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2012-03-15 US disclosed
US-20120065235-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS SYNTA PHARMACEUTICALS CORP. 2012-03-15 US disclosed
US-8093425-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2012-01-10 US disclosed
US-8093425-B2 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2012-01-10 US disclosed
US-20090023736-A1 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2009-01-22 US disclosed
US-20090023736-A1 Compounds for treating proliferative disorders SYNTA PHARMACEUTICALS CORP. (US) 2009-01-22 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 (5 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-20090023736-A1 Compounds for treating proliferative disorders HSP90AB1, HSF1, HSP90B1 AKT1 3231/4885POLB 1588/4885CTSL 2242/4885
US-20120065235-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS HSP90AB1, HSF1, HSP90B1 AKT1 3231/4885POLB 1588/4885CTSL 2242/4885
US-20120095103-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS HSP90AB1, HSF1, HSP90B1 AKT1 3231/4885POLB 1588/4885CTSL 2242/4885
US-20140342999-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS HSP90AB1, HSF1, HSP90B1 AKT1 3231/4885POLB 1588/4885CTSL 2242/4885
US-20140031429-A1 COMPOUNDS FOR TREATING PROLIFERATIVE DISORDERS HSP90AB1, HSF1, HSP90B1 AKT1 3231/4885POLB 1588/4885CTSL 2242/4885

“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.