SCHEMBL19689876

SCHEMBL19689876

C=C(/C=C\CC)N1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.39
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 2/20 0.36
PDK1 Q15118 2/20 0.36
PDK2 Q15119 2/20 0.36
PDK3 Q15120 2/20 0.36
FAAH O00519 1/20 0.36
PHGDH O43175 1/20 0.36
ALDH2 P05091 1/20 0.36
MGLL Q99685 1/20 0.36
RECQL P46063 1/20 0.36
MAPT P10636 1/20 0.36
POLB P06746 3/20 0.35
LMNA P02545 2/20 0.34
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA9 Q16790 3/20 0.33
CA2 P00918 2/20 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
SCHEMBL27861597 0.82 L3MBTL1 (0.31) L3MBTL1MGLL
SCHEMBL27861598 0.80 L3MBTL1 (0.33) L3MBTL1ALDH1A1PHGDHALDH2MGLL
SCHEMBL17071596 0.79 MAPT (0.39) HTTTSHRL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL15713785 0.78 SMN1; SMN2 (0.40) HTTTSHRSMN1; SMN2ALDH1A1PDK1
SCHEMBL21266696 0.77 HTT (0.43) HTTTSHRL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL241262 0.77 RAB9A (0.47) HTTTSHRL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL20934738 0.76
SCHEMBL25867515 0.76 SMN1; SMN2 (0.43) HTTTSHRSMN1; SMN2ALDH1A1PDK1
SCHEMBL24092979 0.76 PHGDH (0.41) SMN1; SMN2ALDH1A1PHGDHMGLLRECQL
SCHEMBL14429968 0.74 HTT (0.38) HTTTSHRSMN1; SMN2ALDH1A1PDK1

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-10752640-B2 Compounds active towards bromodomains NUEVOLUTION A/S (DK) 2020-08-25 US disclosed
US-20170349607-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS NUEVOLUTION A/S (DK) 2017-12-07 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-20170349607-A1 COMPOUNDS ACTIVE TOWARDS BROMODOMAINS BRD4, BRD3, BRDT HTT 1293/4885TSHR 3378/4885L3MBTL1 2388/4885
US-10752640-B2 Compounds active towards bromodomains BRD4, BRD3, BRDT HTT 1293/4885TSHR 3378/4885L3MBTL1 2388/4885

“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.