SCHEMBL1753783

SCHEMBL1753783

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

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.36
MAPT P10636 5/20 0.32
LMNA P02545 3/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 1/20 0.32
RAB9A P51151 3/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
NPR3 P17342 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
RECQL P46063 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CYP3A4 P08684 1/20 0.32
THRB P10828 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ALOX12 P18054 1/20 0.32
ATM Q13315 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL1753513 0.93 RXFP1 (0.37) RXFP1MAPTLMNAALDH1A1HPGD
SCHEMBL1753753 0.88 MEN1 (0.45) RXFP1MAPTLMNAL3MBTL1SMN1; SMN2
SCHEMBL1753510 0.88 MEN1 (0.45) RXFP1MAPTLMNAL3MBTL1SMN1; SMN2
SCHEMBL1753516 0.87 MEN1 (0.44) MAPTLMNAL3MBTL1SMN1; SMN2KDM4E
SCHEMBL1753754 0.87 MEN1 (0.44) MAPTLMNAL3MBTL1SMN1; SMN2KDM4E
SCHEMBL1753615 0.78 ABCB1 (0.42) RXFP1MAPTLMNAALDH1A1RAB9A
SCHEMBL1753750 0.76 ROCK2 (0.43) RXFP1MAPTLMNAALDH1A1NPR3
SCHEMBL1753759 0.73 MEN1 (0.46) MAPTL3MBTL1SMN1; SMN2MEN1KMT2A
SCHEMBL1753584 0.72 MEN1 (0.46) MAPTL3MBTL1SMN1; SMN2MEN1KMT2A
SCHEMBL19901428 0.69 MEN1 (0.54) RXFP1MAPTLMNAHPGDRAB9A

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 1025/4885MAPT 2062/4885LMNA 1947/4885

“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.