SCHEMBL17864484

SCHEMBL17864484

CC(=O)OC(=O)C(C)(C)COCC(C)(C)C(=O)OC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
PRSS1 P07477 1/20 0.35
CTSG P08311 1/20 0.35
CTRB1 P17538 1/20 0.35
CMA1 P23946 1/20 0.35
GAA P10253 1/20 0.34
LMNA P02545 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
SCHEMBL28862361 0.81 ALDH1A1 (0.35) ALDH1A1TSHRHSD17B10TDP1PRSS1
SCHEMBL28358147 0.80 ALDH1A1 (0.43) ALDH1A1TSHRHSD17B10TDP1PRSS1
SCHEMBL1417855 0.80 ALDH1A1 (0.43) ALDH1A1TSHRHSD17B10TDP1PRSS1
SCHEMBL11757494 0.78 ALDH1A1 (0.40) ALDH1A1TSHRHSD17B10PRSS1CTSG
SCHEMBL1345757 0.78 ALDH1A1 (0.41) ALDH1A1TSHRHSD17B10TDP1PRSS1
SCHEMBL1406215 0.76 ALDH1A1 (0.39) ALDH1A1TSHRHSD17B10TDP1PRSS1
SCHEMBL9771379 0.76 ELANE (0.44) ALDH1A1TSHRHSD17B10TDP1PRSS1
SCHEMBL1406216 0.76 HMGCR (0.42) ALDH1A1TSHRHSD17B10TDP1PRSS1
SCHEMBL28407345 0.75 ALDH1A1 (0.38) ALDH1A1TSHRHSD17B10TDP1GAA
SCHEMBL11758393 0.75 PRSS1 (0.36) HSD17B10TDP1PRSS1CTSGCTRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9782432-B2 Polymers and methods thereof for wound healing RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2017-10-10 US disclosed
US-20160175343-A1 POLYMERS AND METHODS THEREOF FOR WOUND HEALING RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2016-06-23 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-20160175343-A1 POLYMERS AND METHODS THEREOF FOR WOUND HEALING COL1A1, FGB, CD68 ALDH1A1 262/4885TSHR 4750/4885HSD17B10 2079/4885

“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.