SCHEMBL21392834

SCHEMBL21392834

COc1ccc(C2CCCCCN2C(=O)CCl)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.54
KDM4E B2RXH2 2/20 0.50
LMNA P02545 2/20 0.47
OPRM1 P35372 1/20 0.47
OPRK1 P41145 1/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 1/20 0.47
CPT1A P50416 2/20 0.45
CPT2 P23786 1/20 0.45
SCD5 Q86SK9 2/20 0.45
ALDH1A1 P00352 1/20 0.45
SCD O00767 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL5195419 0.81 HSD17B10 (0.58) HSD17B10KDM4ELMNAOPRM1OPRK1
SCHEMBL21392838 0.80 ROCK2 (0.52) HSD17B10KDM4ELMNAOPRM1OPRK1
SCHEMBL17142324 0.78 HSD17B10 (0.64) HSD17B10LMNAOPRM1OPRK1SCD5
SCHEMBL29585212 0.78 HSD17B10 (0.55) HSD17B10KDM4ELMNAOPRM1OPRK1
SCHEMBL7729871 0.77 TSHR (0.66) HSD17B10LMNAKMT2AMEN1SCD5
SCHEMBL21392963 0.77 ALDH1A1 (0.48) HSD17B10KDM4ELMNAALDH1A1SCD
SCHEMBL17024860 0.74 KMT2A (0.71) LMNAKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL17024862 0.74 KMT2A (0.71) LMNAKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL21393226 0.74 HSD17B10 (0.59) HSD17B10OPRM1OPRK1SCD5ALDH1A1
SCHEMBL17151071 0.74 HSD17B10 (0.59) HSD17B10KDM4EOPRM1OPRK1SCD5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11666661-B2 Methods and compounds for targeted autophagy THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-06 US disclosed
US-11666661-B2 Methods and compounds for targeted autophagy THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-06-06 US disclosed
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-02 US disclosed
US-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY FRONTIER MEDICINES CORPORATION 2019-09-26 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 (3 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-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY ATG7, BECN1, SQSTM1 HSD17B10 2792/4885KDM4E 3016/4885LMNA 1016/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 HSD17B10 3600/4885KDM4E 210/4885LMNA 3321/4885
US-11666661-B2 Methods and compounds for targeted autophagy ATG7, BECN1, SQSTM1 HSD17B10 2792/4885KDM4E 3016/4885LMNA 1016/4885

“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.