SCHEMBL1601328

SCHEMBL1601328

O=C(O)c1cc2cn[nH]c2cc1F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 3/20 0.47
WNT3A P56704 3/20 0.47
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ROCK1 Q13464 5/20 0.43
ROCK2 O75116 4/20 0.43
KDM4E B2RXH2 1/20 0.43
ASPH Q12797 1/20 0.43
KDM8 Q8N371 1/20 0.43
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
TRPA1 O75762 2/20 0.43
CHEK1 O14757 1/20 0.43
FGFR1 P11362 1/20 0.43
FGFR2 P21802 1/20 0.43
GRK2 P25098 1/20 0.43
JAK2 O60674 1/20 0.42
MAOB P27338 2/20 0.42

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
Formaldehyde SCHEMBL27789252 0.97 CTNNB1 (0.45) CTNNB1WNT3ANPC1RAB9AHPGD
SCHEMBL25413317 0.93 CTNNB1 (0.47) CTNNB1WNT3ANPC1RAB9AHPGD
SCHEMBL29949958 0.81 ROCK2 (0.49) CTNNB1WNT3ANPC1RAB9AHPGD
SCHEMBL4144213 0.81 TSHR (0.47) CTNNB1WNT3ANPC1RAB9AHPGD
SCHEMBL1600048 0.81 CTNNB1 (0.47) CTNNB1WNT3ANPC1RAB9AROCK1
SCHEMBL11261159 0.79 CHEK1 (0.61) CTNNB1WNT3ANPC1RAB9AHPGD
SCHEMBL23149316 0.79 FABP3 (0.49) CTNNB1WNT3ANPC1RAB9AHPGD
SCHEMBL27817106 0.77 CASP6 (0.50) CTNNB1WNT3ANPC1RAB9AROCK1
SCHEMBL14738406 0.77 CHEK1 (0.56) RAB9AHPGDROCK1ROCK2KDM4E
SCHEMBL25247945 0.76 CHEK1 (0.61) CTNNB1WNT3ANPC1RAB9AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250136592-A1 C-LINKED INHIBITORS OF ENL/AF9 YEATS BRIDGE MEDICINES 2025-05-01 US disclosed
CN-117858877-A C-linked inhibitors of ENL/AF9 YEATS 桥梁药品有限公司 2024-04-09 CN disclosed
EP-1809282-B1 THIADIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2013-01-09 EP disclosed
US-7919514-B2 Protein kinase B inhibitors; anticarcinogenic, antiinflammatory and antiproliferative agents; metabolic disorders; 3-(3-fluoro-phenyl)-N-[5-(3-methyl-1H-indazol-5-yl)-[1,3,4]thiadiazol-2-yl]-propane-1,2-diamine and derivatives AMGEN INC. (US) 2011-04-05 US disclosed
US-7700636-B2 Thiadiazole compounds and methods of use AMGEN INC. (US) 2010-04-20 US disclosed
CN-101389335-A Thiadiazole compounds and methods of use. AMGEN INC (US) 2009-03-18 CN disclosed
US-20080269243-A1 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-10-30 US disclosed
US-20080255145-A1 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-10-16 US disclosed
US-7354944-B2 Thiadiazole compounds and methods of use AMGEN INC. (US) 2008-04-08 US disclosed
US-20060154961-A1 Thiadiazole compounds and methods of use AMGEN INC. 2006-07-13 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 (4 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-20080255145-A1 Thiadiazole compounds and methods of use PDK2, PDK1, PANK2 CTNNB1 1576/4885WNT3A 2110/4885NPC1 2069/4885
US-20080269243-A1 Thiadiazole compounds and methods of use PDK2, PDK1, PANK2 CTNNB1 1576/4885WNT3A 2110/4885NPC1 2069/4885
US-20250136592-A1 C-LINKED INHIBITORS OF ENL/AF9 YEATS MLLT3, MLLT1, YEATS2 CTNNB1 4388/4885WNT3A 4626/4885NPC1 2025/4885
US-20060154961-A1 Thiadiazole compounds and methods of use PDK2, PDK1, PANK2 CTNNB1 1576/4885WNT3A 2110/4885NPC1 2069/4885

“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.