SCHEMBL22636637

SCHEMBL22636637

CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3ccc(N4CCNCC4)cc3oc-2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.43
▸ FPR2 P25090 4/20 0.39
▸ USP2 O75604 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ BLM P54132 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ POLB P06746 2/20 0.39
▸ PPARG P37231 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ NCOR2 Q9Y618 1/20 0.39
▸ FTO Q9C0B1 2/20 0.39
▸ ABCB1 P08183 1/20 0.37
▸ CHRM1 P11229 1/20 0.37
▸ TLR7 Q9NYK1 1/20 0.36
▸ AVPR2 P30518 1/20 0.36
▸ CFTR P13569 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ GOPC Q9HD26 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35

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
Piperazine SCHEMBL1317991 0.82 MEN1 (0.55) TGM2FPR2USP2MEN1BLM
SCHEMBL12763951 0.82 POLB (0.50) TGM2FPR2USP2MEN1BLM
SCHEMBL19494774 0.82 USP2 (0.53) TGM2FPR2USP2MEN1BLM
SCHEMBL15289851 0.81 MEN1 (0.44) TGM2USP2MEN1BLMKMT2A
SCHEMBL18540754 0.81 TGM2 (0.48) TGM2FPR2USP2MEN1BLM
SCHEMBL17109310 0.81 ABCB1 (0.44) TGM2FPR2USP2MEN1BLM
SCHEMBL19494880 0.79 ABCB1 (0.45) TGM2FPR2USP2MEN1BLM
SCHEMBL19635158 0.79 MEN1 (0.42) TGM2FPR2USP2MEN1BLM
SCHEMBL12119403 0.79 TGM2 (0.61) TGM2FPR2USP2MEN1BLM
SCHEMBL3903552 0.79 MEN1 (0.61) TGM2FPR2USP2MEN1BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12241902-B2 Probes for detection of copper THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-03-04 — — US disclosed
US-20220196685-A1 PROBES FOR DETECTION OF COPPER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-06-23 — — US disclosed
WO-2020226972-A1 PROBES FOR DETECTION OF COPPER THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-11-12 — — WO 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-12241902-B2 Probes for detection of copper SOD1, SOD3, CELF2 TGM2 1311/4885FPR2 3092/4885USP2 399/4885

“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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