SCHEMBL12412458

SCHEMBL12412458

CCOCCC(=O)NCCNC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 4/20 0.40
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NAAA Q02083 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 3/20 0.38
CASP2 P42575 1/20 0.37
POLB P06746 1/20 0.36
PCNA P12004 1/20 0.36
EPHX2 P34913 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NAMPT P43490 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
SCHEMBL23729787 0.89 SMN1; SMN2 (0.56) SMN1; SMN2TSHRCASP1CASP7HSD17B10
SCHEMBL2119757 0.84 SMN1; SMN2 (0.46) SMN1; SMN2TSHRNAAARAB9AALDH1A1
SCHEMBL22296982 0.84 NAAA (0.47) TSHRHSD17B10NAAAALDH1A1CASP2
SCHEMBL5836462 0.82 CNR1 (0.46) SMN1; SMN2NAAAALDH1A1
SCHEMBL23342946 0.82 MEN1 (0.42) SMN1; SMN2TSHRNAAAALDH1A1CASP2
SCHEMBL13510958 0.81 TSHR (0.50) SMN1; SMN2TSHRNAAAALDH1A1EPHX2
SCHEMBL23711864 0.81 SMN1; SMN2 (0.44) SMN1; SMN2TSHRNAAARAB9AALDH1A1
SCHEMBL24943529 0.81 SMN1; SMN2 (0.44) SMN1; SMN2TSHRCASP1CASP7HSD17B10
SCHEMBL277913 0.81 SMN1; SMN2 (0.44) SMN1; SMN2TSHRCASP1CASP7HSD17B10
SCHEMBL16133369 0.81 CASP2 (0.55) SMN1; SMN2TSHRNAAACASP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9101670-B2 Conjugates of an anti-TNF-α antibody NEKTAR THERAPEUTICS (US) 2015-08-11 US disclosed
US-20110165112-A1 POLYMER CONJUGATES OF C-PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 US disclosed
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 US disclosed
US-20100021481-A1 CONJUGATES OF AN ANTI-TNF-ALPHA ANTIBODY NEKTAR THERAPEUTICS (US) 2010-01-28 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 (3 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-20100021481-A1 CONJUGATES OF AN ANTI-TNF-ALPHA ANTIBODY TNF, TNFRSF1A, TNFRSF9 SMN1; SMN2 2077/4885TSHR 1900/4885CASP1 1333/4885
US-20110165112-A1 POLYMER CONJUGATES OF C-PEPTIDES IAPP, GCG, INSR SMN1; SMN2 2811/4885TSHR 2225/4885CASP1 3783/4885
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP SMN1; SMN2 1660/4885TSHR 2749/4885CASP1 4042/4885

“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.