SCHEMBL17971068

SCHEMBL17971068

Cc1cccc(C(=O)NCCCC(CCCNC(=O)c2cccc(C)c2OCc2ccccc2)(CCCNC(=O)c2cccc(C)c2OCc2ccccc2)C(=O)O)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ PTGER4 P35408 2/20 0.43
▸ PTGER3 P43115 2/20 0.43
▸ PTGER2 P43116 2/20 0.43
▸ PTGER1 P34995 1/20 0.43
▸ PTGDR2 Q9Y5Y4 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ HCRTR1 O43613 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ SGMS2 Q8NHU3 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ GAA P10253 1/20 0.40

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
SCHEMBL17971057 0.90 HPGD (0.44) HPGDSMN1; SMN2L3MBTL1KMT2AMEN1
SCHEMBL6357661 0.74 SGMS2 (0.52) HPGDSMN1; SMN2L3MBTL1KMT2AMEN1
SCHEMBL2228229 0.73 HPGD (0.67) HPGDSMN1; SMN2ALDH1A1POLBNPC1
SCHEMBL1396290 0.73 ALDH1A1 (0.57) HPGDSMN1; SMN2L3MBTL1KMT2APTGER4
SCHEMBL17974510 0.72 ALDH1A1 (0.58) HPGDKMT2AMEN1ALDH1A1HCRTR1
SCHEMBL16039621 0.72 LMNA (0.57) HPGDSMN1; SMN2L3MBTL1KMT2APTGER4
SCHEMBL17530107 0.71 TSHR (0.63) HPGDSMN1; SMN2L3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL18037169 0.71 ALDH1A1 (0.55) HPGDSMN1; SMN2L3MBTL1KMT2APTGER4
SCHEMBL21023149 0.71 SGMS2 (0.54) HPGDL3MBTL1KMT2AMEN1ALDH1A1
SCHEMBL6358805 0.71 SGMS2 (0.61) HPGDL3MBTL1PTGER1PTGDR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160221992-A1 DENDRITIC COMPOUNDS INCLUDING A CHELATING, FLUOROCHROME OR RECOGNITION AGENT, COMPOSITIONS INCLUDING SAME AND USES THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE - CNRS (FR) 2016-08-04 — — 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-20160221992-A1 DENDRITIC COMPOUNDS INCLUDING A CHELATING, FLUOROCHROME OR RECOGNITION AGENT, COMPOSITIONS INCLUDING SAME AND USES THEREOF MSR1, CD74, CD4 HPGD 3144/4885SMN1; SMN2 4449/4885L3MBTL1 3264/4885

“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.

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