SCHEMBL15428417

SCHEMBL15428417

CC(=O)CCCC(=O)NCCOCCOCC(C)=O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.47
▸ CES2 O00748 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ GLP1R P43220 8/20 0.39
▸ CA12 O43570 4/20 0.37
▸ CA1 P00915 4/20 0.37
▸ CA2 P00918 4/20 0.37
▸ CA4 P22748 4/20 0.37
▸ CA9 Q16790 4/20 0.37
▸ CA14 Q9ULX7 4/20 0.37
▸ CNR1 P21554 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ RECQL P46063 1/20 0.34

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
SCHEMBL12147645 0.93 TSHR (0.47) TSHRCES2MEN1KMT2AGLP1R
SCHEMBL16478824 0.90 TSHR (0.45) TSHRCES2GLP1R
SCHEMBL24484088 0.89 CES2 (0.51) TSHRCES2GLP1RCNR1
SCHEMBL22198374 0.88 TSHR (0.52) TSHRMEN1KMT2AGLP1RCA12
SCHEMBL19369668 0.88 GLP1R (0.44) TSHRCES2MEN1KMT2AGLP1R
SCHEMBL26020180 0.87 CES2 (0.54) CES2GLP1RCNR1
SCHEMBL13255985 0.87 TSHR (0.47) TSHRMEN1KMT2AGLP1RCA12
SCHEMBL24253207 0.86 TSHR (0.44) TSHRCES2MEN1KMT2AGLP1R
SCHEMBL23729785 0.86 SMN1; SMN2 (0.50) TSHRCES2GLP1RSMN1; SMN2
SCHEMBL12666120 0.86 GLP1R (0.47) TSHRCES2GLP1RCNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017204445-A2 PHARMACEUTICAL COMPOSITION INDUCING DECOMPOSITION OF ALK PROTEIN, AND PHARMACEUTICAL COMPOSITION FOR CANCER PREVENTION OR TREATMENT CONTAINING SAME AS ACTIVE COMPONENT 한국화학연구원 2017-11-30 — — WO disclosed
US-20140205545-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS DYAX CORP. (US) 2014-07-24 — — US disclosed
US-8663603-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO SUISSE SA (CH) 2014-03-04 — — US disclosed
US-8632753-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO SUISSE SA (CH) 2014-01-21 — — US disclosed
US-20110286929-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS BRACCO INTERNATIONAL B.V. (NL) 2011-11-24 — — US disclosed
US-7261876-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO INTERNATIONAL BV (NL) 2007-08-28 — — 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 (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-20140205545-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS CD47, BCR, CD44 TSHR 2125/4885CES2 2949/4885MEN1 202/4885
US-20110286929-A1 MULTIVALENT CONSTRUCTS FOR THERAPEUTIC AND DIAGNOSTIC APPLICATIONS CD47, BCR, CD44 TSHR 2125/4885CES2 2949/4885MEN1 202/4885

“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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