SCHEMBL10105974

SCHEMBL10105974

O=C(CI)Nc1cccc(C(=O)ON2C(=O)CC(S(=O)(=O)O)C2=O)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 3/20 0.41
LMNA P02545 3/20 0.39
ALDH1A1 P00352 8/20 0.38
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MEN1 O00255 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HPGD P15428 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL2179698 0.88 ALDH1A1 (0.40) KMT2ALMNAALDH1A1SMN1; SMN2MEN1
SCHEMBL15080489 0.83 L3MBTL1 (0.43) L3MBTL1KMT2ALMNAALDH1A1TSHR
SCHEMBL10076741 0.81 L3MBTL1 (0.45) L3MBTL1KMT2ALMNAALDH1A1TSHR
SCHEMBL21167217 0.78 ALDH1A1 (0.38) KMT2ALMNAALDH1A1TSHRSMN1; SMN2
SCHEMBL29382448 0.78 ALDH1A1 (0.38) L3MBTL1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL16848723 0.77 KMT2A (0.42) KMT2AALDH1A1SMN1; SMN2MEN1HPGD
SCHEMBL29351152 0.75 GAA (0.41) L3MBTL1KMT2ATSHRSMN1; SMN2MEN1
SCHEMBL4289308 0.75 GAA (0.41) L3MBTL1KMT2ATSHRSMN1; SMN2MEN1
SCHEMBL9294612 0.74 GAA (0.40) L3MBTL1KMT2ATSHRSMN1; SMN2MEN1
SCHEMBL4432965 0.72 GAA (0.36) KMT2ALMNAALDH1A1TSHRMEN1

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-20120046240-A9 Method of Producing Hydroxyalkyl Starch Derivatives FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2012-02-23 US disclosed
US-20100317609-A1 Method of Producing Hydroxyalkyl Starch Derivatives FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2010-12-16 US disclosed
US-7815893-B2 Hydroxyalkyl starch derivatives FRESENIUS KABI DEUTSCHLAND GMBH (DE) 2010-10-19 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-20120046240-A9 Method of Producing Hydroxyalkyl Starch Derivatives HACL2, HAAO, LIPA L3MBTL1 4722/4885KMT2A 4044/4885LMNA 1793/4885
US-20100317609-A1 Method of Producing Hydroxyalkyl Starch Derivatives HACL2, HAAO, LIPA L3MBTL1 4722/4885KMT2A 4044/4885LMNA 1793/4885

“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.