SCHEMBL22645649

SCHEMBL22645649

BC(B)(OC(=O)c1ccccc1)C(B)(B)C1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.43
▸ HRH1 P35367 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ SCN1A P35498 1/20 0.43
▸ SCN2A Q99250 1/20 0.43
▸ SCN3A Q9NY46 1/20 0.43
▸ CHRNA7 P36544 1/20 0.38
▸ F2 P00734 1/20 0.37
▸ SLC6A4 P31645 2/20 0.37
▸ SLC6A3 Q01959 2/20 0.37
▸ SIGMAR1 Q99720 2/20 0.36
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ CHRM2 P08172 1/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ CHRM1 P11229 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
SCHEMBL22372789 0.79 TSHR (0.46) LMNAHRH1MEN1KMT2ACYP2D6
SCHEMBL22645614 0.78 GBA1 (0.42) LMNAHRH1MEN1KMT2ACYP2D6
SCHEMBL22372854 0.75 ALDH1A1 (0.43) LMNAHRH1MEN1KMT2ACYP2D6
SCHEMBL22372855 0.72 SCN1A (0.45) LMNAHRH1MEN1KMT2ACYP2D6
SCHEMBL22373044 0.71 MEN1 (0.41) LMNAHRH1MEN1KMT2ACYP2D6
SCHEMBL22374191 0.70 CHRNB2 (0.42) LMNAHRH1MEN1KMT2ACYP2D6
SCHEMBL1912949 0.70 CHRNA7 (0.61) HRH1MEN1KMT2ASCN1ASCN2A
SCHEMBL2777615 0.70 CHRM3 (0.58) KMT2ACHRNA7SLC6A3MAPK1HIF1A
SCHEMBL22373531 0.70 ITGB3 (0.40) LMNAHRH1MEN1KMT2ACYP2D6
SCHEMBL22372876 0.69 MAPT (0.42) LMNAHRH1MEN1KMT2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11136330-B2 Synthesis of labeled imidazo[1,2-A]pyrimidines GENENTECH, INC. (US) 2021-10-05 — — US disclosed
US-20200354369-A1 SYNTHESIS OF LABELED IMIDAZO[1,2-A]PYRIMIDINES GENENTECH, INC. (US) 2020-11-12 — — 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 (2 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-11136330-B2 Synthesis of labeled imidazo[1,2-A]pyrimidines TYMS, TYMP, PAICS LMNA 2616/4885HRH1 4017/4885MEN1 531/4885
US-20200354369-A1 SYNTHESIS OF LABELED IMIDAZO[1,2-A]PYRIMIDINES TYMS, TYMP, PAICS LMNA 2616/4885HRH1 4017/4885MEN1 531/4885

“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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