SCHEMBL13968119

SCHEMBL13968119

Cc1ccc(-c2cc(Br)cnc2N)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 2/20 0.54
▸ LRRK2 Q5S007 5/20 0.51
▸ USP7 Q93009 4/20 0.50
▸ HTT P42858 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ FYN P06241 2/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ CYP2A6 P11509 1/20 0.45

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
SCHEMBL29857960 1.00 MAP4K4 (0.54) MAP4K4LRRK2USP7HTTALDH1A1
SCHEMBL12489163 0.85 USP7 (0.53) MAP4K4USP7HTTALDH1A1MAPT
SCHEMBL2228665 0.84 USP7 (0.71) MAP4K4USP7HTTKMT2AFYN
SCHEMBL12518227 0.83 CYP2A6 (0.62) MAP4K4LRRK2USP7KMT2AFYN
SCHEMBL2222921 0.83 USP7 (0.51) MAP4K4LRRK2USP7HTTKMT2A
SCHEMBL15359055 0.81 USP7 (0.60) MAP4K4USP7HTTMAPTSMN1; SMN2
SCHEMBL29857982 0.81 ADORA1 (0.49) MAP4K4LRRK2USP7HTTALDH1A1
SCHEMBL12516853 0.81 ADORA1 (0.49) MAP4K4LRRK2USP7HTTALDH1A1
SCHEMBL26916746 0.80 FYN (0.53) MAP4K4USP7HTTMAPTMAPK1
SCHEMBL29582823 0.80 FYN (0.53) MAP4K4USP7HTTMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174683-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2024-05-30 — — US disclosed
EP-4288437-A1 MAP4K1 INHIBITORS Bayer Aktiengesellschaft (DE) 2023-12-13 — — EP disclosed
WO-2022167627-A1 MAP4K1 INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2022-08-11 — — WO disclosed
US-9024033-B2 Anti-malarial agents MMV MEDICINES FOR MALARIA VENTURE (CH) 2015-05-05 — — US disclosed
US-20120295905-A1 NEW ANTI-MALARIAL AGENTS MMV MEDICINES FOR MALARIA VENTURE (CH) 2012-11-22 — — 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-20240174683-A1 MAP4K1 INHIBITORS MAP3K4, MAP4K4, MAP4K1 MAP4K4 2/4885LRRK2 309/4885USP7 4285/4885
US-20120295905-A1 NEW ANTI-MALARIAL AGENTS QDPR, DHFR, ITPA MAP4K4 1556/4885LRRK2 4093/4885USP7 4381/4885

“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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