SCHEMBL21392795

SCHEMBL21392795

CN(Cc1cccc(C(F)(F)F)c1)C(=O)CCl

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 3/20 0.52
ALDH1A1 P00352 5/20 0.51
HTT P42858 2/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HDAC6 Q9UBN7 1/20 0.47
KDM4E B2RXH2 2/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
ACP3 P15309 1/20 0.47
PDK1 Q15118 1/20 0.46
OPRM1 P35372 1/20 0.45
OPRL1 P41146 1/20 0.45
MTOR P42345 1/20 0.45
CETP P11597 1/20 0.45
EPHX1 P07099 1/20 0.45
AOC3 Q16853 1/20 0.45

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
SCHEMBL29565828 0.87 TACR1 (0.53) TACR1RAB9AMEN1KMT2AHDAC6
SCHEMBL6410982 0.84 HDAC6 (0.56) TACR1ALDH1A1MEN1KMT2AHDAC6
SCHEMBL21789134 0.82 ALDH1A1 (0.66) TACR1ALDH1A1HTTRAB9AMEN1
SCHEMBL3878422 0.77 TACR1 (0.53) TACR1RAB9AMEN1KMT2AHDAC6
SCHEMBL14955365 0.77 POLQ (0.51) TACR1ALDH1A1
SCHEMBL991685 0.76 RAB9A (0.72) ALDH1A1HTTRAB9AMEN1KMT2A
SCHEMBL4243270 0.76 HTR2A (0.56) ALDH1A1MEN1KMT2AHDAC6KDM4E
SCHEMBL11239160 0.76 MEN1 (0.55) TACR1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6415244 0.76 MEN1 (0.47) TACR1ALDH1A1MEN1KMT2AHDAC6
SCHEMBL6415243 0.76 MEN1 (0.47) TACR1ALDH1A1MEN1KMT2AHDAC6

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 5 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
WO-2019183600-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-09-26 WO 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 TACR1 4637/4885ALDH1A1 4188/4885HTT 238/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 TACR1 4803/4885ALDH1A1 2969/4885HTT 546/4885
US-11666661-B2 Methods and compounds for targeted autophagy ATG7, BECN1, SQSTM1 TACR1 4637/4885ALDH1A1 4188/4885HTT 238/4885

“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.