SCHEMBL12200847

SCHEMBL12200847

COCCCCC(=O)OCCOC

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.59
ALDH1A1 P00352 1/20 0.56
DNM1 Q05193 1/20 0.44
TSHR P16473 4/20 0.42
PRSS1 P07477 1/20 0.42
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
ADRA2A P08913 1/20 0.41
ADRA1A P35348 1/20 0.41
MAPT P10636 1/20 0.40
BLM P54132 1/20 0.40
PAM P19021 2/20 0.39
HTR2C P28335 1/20 0.39
NAAA Q02083 1/20 0.39
CYP1A2 P05177 1/20 0.39
EPHX2 P34913 1/20 0.37

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
SCHEMBL17914317 0.95 DGKA (0.65) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL1033327 0.95 DGKA (0.64) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL28922182 0.93 DGKA (0.68) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL13343463 0.93 ALDH1A1 (0.58) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL13751390 0.92 DGKA (0.57) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL813660 0.91 DGKA (0.58) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL813905 0.91 DGKA (0.58) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL12417283 0.90 DGKA (0.59) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL9903196 0.89 DGKA (0.57) DGKAALDH1A1DNM1TSHRPRSS1
SCHEMBL17998754 0.89 DGKA (0.57) DGKAALDH1A1DNM1TSHRPRSS1

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-20180112033-A1 POLYESTER NANOGEL CORE STAR POLYMERS FOR DELIVERY OF THERAPEUTIC AGENTS INTERNATIONAL BUSINESS MACHINES CORPORATION 2018-04-26 US disclosed
US-8765098-B2 Star polymers, methods of preparation thereof, and uses thereof INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2014-07-01 US disclosed
US-20110243848-A1 STAR POLYMERS, METHODS OF PREPARATION THEREOF, AND USES THEREOF INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2011-10-06 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-20110243848-A1 STAR POLYMERS, METHODS OF PREPARATION THEREOF, AND USES THEREOF AS3MT, STARD7, MCM5 DGKA 1441/4885ALDH1A1 4841/4885DNM1 3376/4885
US-20180112033-A1 POLYESTER NANOGEL CORE STAR POLYMERS FOR DELIVERY OF THERAPEUTIC AGENTS STARD10, STARD7, ABCB7 DGKA 2464/4885ALDH1A1 3145/4885DNM1 3787/4885

“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.