SCHEMBL1753513

SCHEMBL1753513

CC(C)Nc1ccc(C=C(COC(=O)Nc2ccc(C=C(COC(=O)C(C)(C)C)COC(=O)C(C)(C)C)cc2)COC(=O)Nc2ccc(C=C(COC(=O)C(C)(C)C)COC(=O)C(C)(C)C)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.37
RAB9A P51151 4/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
HPGD P15428 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
NPC1 O15118 2/20 0.36
NLRP3 Q96P20 5/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 2/20 0.33
TRPV1 Q8NER1 1/20 0.33
NPR3 P17342 1/20 0.33
NPSR1 Q6W5P4 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
SCHEMBL1753754 0.94 MEN1 (0.44) L3MBTL1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL1753516 0.94 MEN1 (0.44) L3MBTL1SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL1753783 0.93 RXFP1 (0.36) RXFP1RAB9AL3MBTL1HPGDSMN1; SMN2
SCHEMBL1753510 0.92 MEN1 (0.45) RXFP1L3MBTL1SMN1; SMN2LMNAMEN1
SCHEMBL1753753 0.92 MEN1 (0.45) RXFP1L3MBTL1SMN1; SMN2LMNAMEN1
SCHEMBL1753584 0.80 MEN1 (0.46) L3MBTL1SMN1; SMN2NLRP3MEN1KMT2A
SCHEMBL1753759 0.79 MEN1 (0.46) L3MBTL1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL1753582 0.77 MEN1 (0.54) RXFP1RAB9AL3MBTL1HPGDSMN1; SMN2
SCHEMBL19901428 0.77 MEN1 (0.54) RXFP1RAB9AL3MBTL1HPGDSMN1; SMN2
SCHEMBL13411037 0.74 ALDH1A1 (0.44) RAB9AHPGDSMN1; SMN2NPC1NLRP3

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-8158590-B2 Triazole-containing releasable linkers, conjugates thereof, and methods of preparation SYNTARGA B.V. (NL) 2012-04-17 US disclosed
US-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation BYONDIS B.V. (NL) 2008-12-18 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-20080311136-A1 Triazole-Containing Releasable Linkers, Conjugates Thereof, and Methods of Preparation PAICS, CD44, TRIM33 RXFP1 1025/4885RAB9A 2555/4885L3MBTL1 1945/4885

“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.