SCHEMBL20152005

SCHEMBL20152005

CCCOCCC(=O)OCCOCCC(=O)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.43
HSD17B10 Q99714 1/20 0.34
MAPT P10636 2/20 0.34
EPHX2 P34913 2/20 0.34
ALDH1A1 P00352 4/20 0.33
ADRA2A P08913 1/20 0.33
ADRA1A P35348 1/20 0.33
DNM1 Q05193 1/20 0.33
TSHR P16473 1/20 0.33
HTR2C P28335 1/20 0.33
BLM P54132 1/20 0.32
GLA P06280 1/20 0.32
NAAA Q02083 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL25818778 0.89 ADRA2A (0.38) DGKAMAPTADRA2AADRA1ADNM1
SCHEMBL20661419 0.89 HSD17B10 (0.41) HSD17B10MAPTALDH1A1TSHRBLM
SCHEMBL20661433 0.89 HSD17B10 (0.41) HSD17B10MAPTALDH1A1TSHRBLM
SCHEMBL19884905 0.87 HSD17B10 (0.43) DGKAHSD17B10EPHX2ALDH1A1TSHR
SCHEMBL443342 0.81 DGKA (0.50) DGKAMAPTALDH1A1ADRA2AADRA1A
SCHEMBL17871681 0.81 DGKA (0.56) DGKAHSD17B10MAPTEPHX2ALDH1A1
SCHEMBL18751718 0.81 MEN1 (0.40) HSD17B10ALDH1A1TSHRBLM
SCHEMBL18751715 0.81 MEN1 (0.40) HSD17B10ALDH1A1TSHRBLM
SCHEMBL18751714 0.81 MEN1 (0.40) HSD17B10ALDH1A1TSHRBLM
SCHEMBL18751710 0.81 MEN1 (0.40) HSD17B10ALDH1A1TSHRBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180133333-A1 BIODEGRADABLE THERMO-RESPONSIVE POLYMERS AND USES THEREOF Tht Trustees of Columbia University in the City of New York (US) 2018-05-17 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-20180133333-A1 BIODEGRADABLE THERMO-RESPONSIVE POLYMERS AND USES THEREOF HEATR6, CHIA, HSF1 DGKA 1984/4885HSD17B10 450/4885MAPT 112/4885

“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.