SCHEMBL4309482

SCHEMBL4309482

CC(=O)Nc1cc(CCl)ccn1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
JAK2 O60674 1/20 0.49
JAK1 P23458 1/20 0.49
TYK2 P29597 1/20 0.49
NR3C2 P08235 9/20 0.48
PIK3C3 Q8NEB9 6/20 0.47
AURKA O14965 1/20 0.45
GSK3A P49840 1/20 0.45
GSK3B P49841 1/20 0.45
AAK1 Q2M2I8 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.44

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
Hydrochloric Acid SCHEMBL17161867 0.98 L3MBTL1 (0.49) L3MBTL1JAK2JAK1TYK2NR3C2
SCHEMBL4587020 0.86 TDP1 (0.50) L3MBTL1NR3C2GSK3ALOXL2
SCHEMBL7671508 0.85 L3MBTL1 (0.52) L3MBTL1JAK2JAK1TYK2NR3C2
SCHEMBL91333 0.85 RIOK2 (0.57) L3MBTL1JAK2JAK1TYK2NR3C2
SCHEMBL501285 0.85 L3MBTL1 (0.52) L3MBTL1JAK2JAK1TYK2NR3C2
SCHEMBL9934078 0.85 NR3C2 (0.51) NR3C2LOXL2
SCHEMBL29507273 0.85 L3MBTL1 (0.52) L3MBTL1JAK2JAK1TYK2NR3C2
SCHEMBL31032910 0.84 JAK2 (0.55) JAK2JAK1TYK2NR3C2
SCHEMBL4305979 0.84 JAK2 (0.55) JAK2JAK1TYK2NR3C2
SCHEMBL20305452 0.84 JAK2 (0.51) L3MBTL1JAK2JAK1TYK2NR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023009709-A1 PYRAZOLO PIPERAZINES AS JAK2 INHIBITORS AJAX THERAPEUTICS, INC. (US) 2023-02-02 WO disclosed
WO-2018119387-A1 SMALL MOLECULE INHIBITORS OF COLONY STIMULATING FACTOR-1 RECEPTOR (CSF-1R) AND USES THEREOF TESARO, INC. (US) 2018-06-28 WO disclosed
US-9850225-B2 Compounds useful as immunomodulators BRISTOL-MYERS SQUIBB COMPANY (US) 2017-12-26 US disclosed
WO-2015160641-A2 COMPOUNDS USEFUL AS IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-22 WO disclosed
US-20150291549-A1 Compounds Useful as Immunomodulators BRISTOL-MYERS SQUIBB COMPANY 2015-10-15 US disclosed
US-20090023753-A1 1,3-Thiazole-5-Carboxamides Useful as Cancer Chemotherapeutic Agents BAYER HEALTHCARE AG (DE) 2009-01-22 US disclosed
US-20090023753-A1 1,3-Thiazole-5-Carboxamides Useful as Cancer Chemotherapeutic Agents BAYER HEALTHCARE AG (DE) 2009-01-22 US disclosed
US-20090023753-A1 1,3-Thiazole-5-Carboxamides Useful as Cancer Chemotherapeutic Agents BAYER HEALTHCARE AG (DE) 2009-01-22 US disclosed
US-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents BAYER PHARMACEUTICALS CORPORATION (US) 2008-11-27 US disclosed
US-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents BAYER PHARMACEUTICALS CORPORATION (US) 2008-11-27 US disclosed
US-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents BAYER PHARMACEUTICALS CORPORATION (US) 2008-11-27 US disclosed
WO-2006023707-A2 2-AMINOTHIOPHENECARBOXAMIDES USEFUL AS CANCER CHEMOTHERAPEUTIC AGENTS BAYER PHARMACEUTICALS CORPORATION (US) 2006-03-02 WO 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 (3 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-20150291549-A1 Compounds Useful as Immunomodulators CD74, HLA-DRB1, CD47 L3MBTL1 3856/4885JAK2 730/4885JAK1 1052/4885
US-20080293696-A1 2-Aminoarylcarboxamides Useful as Cancer Chemotherapeutic Agents ABCC3, HCCS, ABCC2 L3MBTL1 2273/4885JAK2 896/4885JAK1 2385/4885
US-20090023753-A1 1,3-Thiazole-5-Carboxamides Useful as Cancer Chemotherapeutic Agents MCL1, HDAC5, HDAC6 L3MBTL1 3079/4885JAK2 315/4885JAK1 1025/4885

“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.