SCHEMBL2519902

SCHEMBL2519902

CCCCCCOC(C)(CN(C)C)OCCCCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.39
CA1 P00915 8/20 0.36
CA2 P00918 8/20 0.36
CA9 Q16790 7/20 0.36
CA12 O43570 3/20 0.36
CA7 P43166 3/20 0.36
CA14 Q9ULX7 3/20 0.36
CA3 P07451 2/20 0.36
CA4 P22748 2/20 0.36
CA6 P23280 2/20 0.36
CA5A P35218 2/20 0.36
CA5B Q9Y2D0 2/20 0.36
RECQL P46063 2/20 0.35
TSHR P16473 2/20 0.35
CES2 O00748 1/20 0.35
GLA P06280 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
EPHX2 P34913 1/20 0.35
BLM P54132 1/20 0.35

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
SCHEMBL6263292 1.00 DNM1 (0.39) DNM1CA1CA2CA9CA12
SCHEMBL2301357 0.91 LPAR2 (0.44)
SCHEMBL935452 0.82 ALDH1A1 (0.41)
SCHEMBL12257499 0.78 LPAR3 (0.41) CA1CA2CA9CA12CA7
SCHEMBL12257497 0.78 LPAR3 (0.41) CA1CA2CA9CA12CA7
SCHEMBL11508110 0.76 THRB (0.38) CA1CA2CA9CA12CA7
SCHEMBL15554489 0.76 THRB (0.38) CA1CA2CA9CA12CA7
SCHEMBL6021113 0.74 MEN1 (0.45) TSHRCES2THRBMEN1HTT
SCHEMBL14118722 0.74 DNM1 (0.42) DNM1CA1CA2CA9CA12
SCHEMBL1254027 0.74 DNM1 (0.42) DNM1CA1CA2CA9CA12

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-20110250641-A1 ZWITTERIONIC ACID-LABILE SURFACTANTS AND METHODS OF USE PROTEA BIOSCIENCES, INC. (A WEST VIRGINIA CORPORATION) 2011-10-13 US disclosed
US-20110250641-A1 ZWITTERIONIC ACID-LABILE SURFACTANTS AND METHODS OF USE PROTEA BIOSCIENCES, INC. (A WEST VIRGINIA CORPORATION) 2011-10-13 US disclosed
US-20110250641-A1 ZWITTERIONIC ACID-LABILE SURFACTANTS AND METHODS OF USE PROTEA BIOSCIENCES, INC. (A WEST VIRGINIA CORPORATION) 2011-10-13 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-20110250641-A1 ZWITTERIONIC ACID-LABILE SURFACTANTS AND METHODS OF USE SGMS1, SGMS2, PHOSPHO1 DNM1 325/4885CA1 187/4885CA2 150/4885

“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.