SCHEMBL30979878

SCHEMBL30979878

c1ncc2ccc(N3CCC(N4CCOCC4)CC3)cc2n1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 1/20 0.44
▸ L3MBTL3 Q96JM7 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ IRAK4 Q9NWZ3 6/20 0.43
▸ PRKDC P78527 5/20 0.43
▸ PIM2 Q9P1W9 1/20 0.42
▸ BMPR1B O00238 1/20 0.42
▸ BMPR1A P36894 1/20 0.42
▸ ACVR1B P36896 1/20 0.42
▸ TGFBR1 P36897 1/20 0.42
▸ ACVR1 Q04771 1/20 0.42
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ TTK P33981 1/20 0.39

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
SCHEMBL2419166 0.87 PRKDC (0.53) L3MBTL1PRKDC
SCHEMBL31302322 0.87 PRKDC (0.53) L3MBTL1PRKDC
SCHEMBL8871292 0.76 PRKDC (0.50) PRKDC
SCHEMBL17420298 0.74 PIM2 (0.53) L3MBTL3L3MBTL1IRAK4PIM2
SCHEMBL23123960 0.72 QPCT (0.54) L3MBTL3L3MBTL1TTK
SCHEMBL20248043 0.72 L3MBTL3 (0.51) L3MBTL3L3MBTL1BMPR1BBMPR1AACVR1B
SCHEMBL419985 0.71 MAPT (0.43) L3MBTL3L3MBTL1BMPR1BBMPR1AACVR1B
SCHEMBL2723240 0.71 L3MBTL3 (0.50) MAP4K4L3MBTL3L3MBTL1BMPR1BBMPR1A
SCHEMBL16427580 0.71 CHRNB2 (0.51) L3MBTL3L3MBTL1BMPR1BBMPR1AACVR1B
SCHEMBL29437377 0.71 L3MBTL3 (0.50) MAP4K4L3MBTL3L3MBTL1BMPR1BBMPR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240246940-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF VORONOI INC. (KR) 2024-07-25 — — US claimed

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-20240246940-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF ERBB2, EGFR, ERBB3 MAP4K4 548/4885L3MBTL3 3253/4885L3MBTL1 3563/4885

“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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