SCHEMBL17045874

SCHEMBL17045874

COC(=O)CCCP(=O)(O)Oc1ccccc1C

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
CCNT1 O60563 1/20 0.41
CDK9 P50750 1/20 0.41
NOTUM Q6P988 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
Dimethyl Succinate SCHEMBL26913162 0.82 TSHR (0.45) TSHRNOTUMALDH1A1SMN1; SMN2NPSR1
SCHEMBL778989 0.82 CETP (0.50) TSHRCCNT1CDK9NOTUMNPSR1
SCHEMBL17045889 0.82 TSHR (0.47) TSHRLMNAKMT2A
SCHEMBL22947676 0.79 CCNT1 (0.48) TSHRCCNT1CDK9NOTUMSMN1; SMN2
SCHEMBL13986558 0.77 MEN1 (0.58) ALDH1A1MEN1LMNAKMT2ATDP1
SCHEMBL14570540 0.76 PPARG (0.56) ALDH1A1MEN1LMNAKMT2ATDP1
SCHEMBL777122 0.75 CCNT1 (0.46) TSHRCCNT1CDK9NOTUMALDH1A1
SCHEMBL17045930 0.74 HDAC3 (0.52) ALDH1A1SMN1; SMN2MEN1LMNAKMT2A
SCHEMBL9205132 0.72 POLB (0.46) TSHRNOTUMALDH1A1SMN1; SMN2NPSR1
SCHEMBL56485 0.72 SLC1A5 (0.46) KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10233201-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury University of Pittsburg—Of the Commonwealth System of Higher Education (US) 2019-03-19 US disclosed
US-20170320898-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2017-11-09 US disclosed
US-9670236-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2017-06-06 US disclosed
US-20150246939-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2015-09-03 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 (3 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-10233201-B2 Class of HDAC inhibitors expands the renal progenitor cells population and improves the rate of recovery from acute kidney injury HDAC1, HDAC9, HDAC11 TSHR 3966/4885CCNT1 1194/4885CDK9 106/4885
US-20150246939-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury HDAC1, HDAC9, HDAC11 TSHR 3966/4885CCNT1 1194/4885CDK9 106/4885
US-20170320898-A1 Class of HDAC Inhibitors Expands the Renal Progenitor Cells Population and Improves the Rate of Recovery from Acute Kidney Injury HDAC1, HDAC9, HDAC11 TSHR 3966/4885CCNT1 1194/4885CDK9 106/4885

“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.