SCHEMBL14701675

SCHEMBL14701675

CCOP(O)OCCCCCCN

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.37
TSHR P16473 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ALDH1A1 P00352 1/20 0.37
EPHX1 P07099 1/20 0.37
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA3 P07451 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
LMNA P02545 1/20 0.33
BLM P54132 1/20 0.33
CPB2 Q96IY4 1/20 0.33

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
SCHEMBL7113540 0.88 DNM1 (0.54) DNM1TSHRMEN1KMT2AALDH1A1
SCHEMBL1261493 0.83 THRB (0.40) TSHRMEN1KMT2AEPHX1CA12
SCHEMBL11498627 0.83 THRB (0.40) TSHRMEN1KMT2AEPHX1CA12
SCHEMBL5678028 0.83 THRB (0.40) TSHRMEN1KMT2AEPHX1CA12
SCHEMBL1259444 0.83 THRB (0.40) TSHRMEN1KMT2AEPHX1CA12
SCHEMBL1260703 0.83 THRB (0.40) TSHRMEN1KMT2AEPHX1CA12
SCHEMBL1261292 0.83 THRB (0.40) TSHRMEN1KMT2AEPHX1CA12
SCHEMBL14817635 0.81 DNM1 (0.35) DNM1TSHRMEN1KMT2AALDH1A1
SCHEMBL10714303 0.80 CA12 (0.37) TSHRMEN1KMT2AEPHX1CA12
SCHEMBL28175118 0.78 TSHR (0.37) TSHRALDH1A1CA1CA2

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-20130041133-A1 NOVEL SINGLE CHEMICAL ENTITIES AND METHODS FOR DELIVERY OF OLIGONUCLEOTIDES BANK OF AMERICA, N.A. 2013-02-14 US disclosed
US-20130041133-A1 NOVEL SINGLE CHEMICAL ENTITIES AND METHODS FOR DELIVERY OF OLIGONUCLEOTIDES BANK OF AMERICA, N.A. 2013-02-14 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-20130041133-A1 NOVEL SINGLE CHEMICAL ENTITIES AND METHODS FOR DELIVERY OF OLIGONUCLEOTIDES PHAX, NSUN3, NSUN2 DNM1 927/4885TSHR 1795/4885MEN1 2770/4885

“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.