SCHEMBL21392800

SCHEMBL21392800

CCC(C)(C)N(C(=O)CCl)c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HTT P42858 2/20 0.49
RNF4 P78317 1/20 0.47
RAB9A P51151 3/20 0.42
MITF O75030 2/20 0.42
NPC1 O15118 2/20 0.42
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
GAA P10253 1/20 0.40
BCL2A1 Q16548 2/20 0.39
KDM4E B2RXH2 1/20 0.38
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
LMNA P02545 2/20 0.38
GLA P06280 1/20 0.38
MAPT P10636 2/20 0.37
HKDC1 Q2TB90 1/20 0.37
TP53 P04637 1/20 0.37
ESR2 Q92731 1/20 0.37

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
SCHEMBL25542747 0.88 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2HTTRAB9ANPC1
SCHEMBL21392780 0.81 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2HTTRAB9AMITF
SCHEMBL21392847 0.78 BCL2A1 (0.49) ALDH1A1SMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL9732732 0.74 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2HTTRNF4RAB9A
SCHEMBL25316112 0.71 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2HTTRNF4RAB9A
SCHEMBL1882869 0.71 GAA (0.50) ALDH1A1SMN1; SMN2HTTRAB9ANPC1
SCHEMBL22699297 0.71 SLC2A1 (0.43) ALDH1A1SMN1; SMN2RAB9ANPC1KMT2A
SCHEMBL11787571 0.70 RNF4 (0.63) ALDH1A1SMN1; SMN2HTTRNF4RAB9A
SCHEMBL28970973 0.70 RNF4 (0.55) ALDH1A1SMN1; SMN2HTTRNF4RAB9A
SCHEMBL2117365 0.69 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2HTTRNF4RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164495-B Covalent targeting of E3 ligases 加利福尼亚大学董事会 2025-04-22 CN disclosed
US-20250120982-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-04-17 US disclosed
US-12161648-B2 Covalent targeting of E3 ligases THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-12-10 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
EP-3863642-A1 COVALENT TARGETING OF E3 LIGASES The Regents of the University of California (US) 2021-08-18 EP disclosed
CN-113164495-A Covalent targeting of E3 ligase 加利福尼亚大学董事会 2021-07-23 CN 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 (5 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-12161648-B2 Covalent targeting of E3 ligases RNF114, RNF4, RNF168 ALDH1A1 2969/4885SMN1; SMN2 1834/4885HTT 546/4885
US-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY ATG7, BECN1, SQSTM1 ALDH1A1 4188/4885SMN1; SMN2 3721/4885HTT 238/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 ALDH1A1 2969/4885SMN1; SMN2 1834/4885HTT 546/4885
US-11666661-B2 Methods and compounds for targeted autophagy ATG7, BECN1, SQSTM1 ALDH1A1 4188/4885SMN1; SMN2 3721/4885HTT 238/4885
US-20250120982-A1 COVALENT TARGETING OF E3 LIGASES STUB1, XIAP, RBX1 ALDH1A1 2485/4885SMN1; SMN2 2872/4885HTT 1558/4885

“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.