SCHEMBL20477127

SCHEMBL20477127

CC=CC(=O)OC(=O)/C=C/CN1CCOCC1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.37
▸ TSHR P16473 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ HSD17B10 Q99714 2/20 0.36
▸ ALOX15 P16050 1/20 0.35
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRD1 P41143 1/20 0.33
▸ BTK Q06187 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ FLT3 P36888 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
SCHEMBL17140903 1.00 KDM4E (0.37) KDM4ETSHRALDH1A1HSD17B10ALOX15
SCHEMBL17140900 0.92 KDM4E (0.41) KDM4ETSHRALDH1A1HSD17B10ALOX15
SCHEMBL17140897 0.92 KDM4E (0.41) KDM4ETSHRALDH1A1HSD17B10ALOX15
Hydrochloric Acid SCHEMBL7407411 0.83 ELANE (0.37) ALDH1A1MEN1KMT2ATDP1BTK
SCHEMBL17150685 0.80 MEN1 (0.39) KDM4ETSHRALDH1A1MEN1KMT2A
SCHEMBL19533587 0.79 TSHR (0.49) KDM4ETSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL15584092 0.78 SMN1; SMN2 (0.46) KDM4ETSHRALDH1A1HSD17B10ALOX15
SCHEMBL16444453 0.78 SMN1; SMN2 (0.46) KDM4ETSHRALDH1A1HSD17B10ALOX15
SCHEMBL17250749 0.77 KDM4E (0.40) KDM4ETSHRALDH1A1HSD17B10ALOX15
SCHEMBL14165795 0.76 KDM4E (0.42) KDM4ETSHRALDH1A1HSD17B10ALOX15

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-10059690-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) SYROS PHARMACEUTICALS, INC. (US) 2018-08-28 — — 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 (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-10059690-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) CDK7, CDK3, CDK9 KDM4E 1501/4885TSHR 3200/4885ALDH1A1 3898/4885

“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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