SCHEMBL21392990

SCHEMBL21392990

C=CC(=O)N1CCN(c2cc(C)nc3ccccc23)CC1

nearest known ligand 0.78

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.78
KMT2A Q03164 4/20 0.78
NCF1 P14598 7/20 0.75
ADRB2 P07550 1/20 0.59
ADRB1 P08588 1/20 0.59
HTT P42858 4/20 0.58
LMNA P02545 3/20 0.58
MAPK1 P28482 3/20 0.58
USP2 O75604 2/20 0.58
HSD17B10 Q99714 2/20 0.58
PKM P14618 1/20 0.58
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
NPSR1 Q6W5P4 2/20 0.53
TSHR P16473 1/20 0.53
KDM4E B2RXH2 1/20 0.52
RECQL P46063 1/20 0.52

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
SCHEMBL900155 0.87 NCF1 (0.82) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL15152940 0.85 MEN1 (0.78) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL15152938 0.85 MEN1 (0.78) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL17276464 0.85 NCF1 (0.79) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL15153001 0.84 KMT2A (0.76) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL15153008 0.84 KMT2A (0.76) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL15153006 0.84 KMT2A (0.76) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL900230 0.83 KMT2A (0.74) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL900227 0.83 KMT2A (0.74) MEN1KMT2ANCF1ADRB2ADRB1
SCHEMBL900228 0.83 KMT2A (0.74) MEN1KMT2ANCF1ADRB2ADRB1

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 7 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-20210369731-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-02 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
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 (4 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 MEN1 2638/4885KMT2A 501/4885NCF1 3558/4885
US-20190290778-A1 METHODS AND COMPOUNDS FOR TARGETED AUTOPHAGY ATG7, BECN1, SQSTM1 MEN1 4319/4885KMT2A 3168/4885NCF1 2297/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 MEN1 2638/4885KMT2A 501/4885NCF1 3558/4885
US-20250120982-A1 COVALENT TARGETING OF E3 LIGASES STUB1, XIAP, RBX1 MEN1 4382/4885KMT2A 869/4885NCF1 2188/4885

“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.