SCHEMBL29366451

SCHEMBL29366451

Clc1cc(Br)c(Cl)c2[nH]ncc12

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NOS1 P29475 4/20 0.40
▸ AXL P30530 1/20 0.36
▸ IDO1 P14902 1/20 0.34
▸ TDO2 P48775 1/20 0.34
▸ METAP2 P50579 1/20 0.30
▸ ALOX15 P16050 1/20 0.30

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
SCHEMBL22804796 1.00 NOS1 (0.40) NOS1AXLIDO1TDO2METAP2
SCHEMBL31393062 0.81 NOS1 (0.38) NOS1AXLIDO1TDO2
SCHEMBL22805867 0.81 NOS1 (0.38) NOS1AXLIDO1TDO2
SCHEMBL29602927 0.81 NOS1 (0.34) NOS1AXLIDO1TDO2METAP2
SCHEMBL22806465 0.78 NOS1 (0.35) NOS1AXLIDO1TDO2METAP2
SCHEMBL29363726 0.78 NOS1 (0.35) NOS1AXLIDO1TDO2METAP2
SCHEMBL23478332 0.74 NOS1 (0.46) NOS1AXLIDO1TDO2METAP2
SCHEMBL22489490 0.74 NOS1 (0.38) NOS1AXLIDO1TDO2METAP2
SCHEMBL19995841 0.74 NOS1 (0.38) NOS1AXLIDO1TDO2METAP2
SCHEMBL30975376 0.74 NOS1 (0.34) NOS1AXLIDO1TDO2METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119173253-A Combination of allosteric and orthosteric EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2024-12-20 — — CN disclosed
CN-113993872-B EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2024-09-24 — — CN disclosed
CN-113966335-B EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2024-08-02 — — CN disclosed
CN-113993873-B EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2024-08-02 — — CN disclosed
CN-114008049-B EGFR inhibitors for cancer treatment 豪夫迈·罗氏有限公司 2024-07-05 — — CN disclosed
CN-114901277-B Isoindolinone and indazole compounds for EGFR degradation C4医药公司 2024-05-17 — — CN disclosed
CN-114901277-A Isoindolinone and indazole compounds for EGFR degradation C4医药公司 2022-08-12 — — CN disclosed
CN-113993872-A EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2022-01-28 — — CN disclosed
CN-113993873-A EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2022-01-28 — — CN disclosed
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