SCHEMBL18500656

SCHEMBL18500656

Cc1cncn1-c1ccc(Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
MAPT P10636 2/20 0.44
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CYP19A1 P11511 1/20 0.42
NOTUM Q6P988 3/20 0.41
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.38
F2 P00734 1/20 0.37
PTK2 Q05397 1/20 0.37
RAB9A P51151 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37

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
SCHEMBL25442241 0.81 CYP3A4 (0.51) CYP3A4CYP2D6CYP2C9HSP90AA1HSP90AB1
SCHEMBL11380013 0.80 CYP3A4 (0.54) CYP3A4CYP2D6CYP2C9HSP90AA1HSP90AB1
SCHEMBL27951163 0.79 CYP3A4 (0.46) CYP3A4CYP2D6CYP2C9MAPTMAOA
SCHEMBL3272205 0.79 CYP3A4 (0.53) CYP3A4CYP2D6CYP2C9HSP90AA1HSP90AB1
SCHEMBL23559029 0.79 CYP3A4 (0.43) CYP3A4CYP2D6CYP2C9MAOAMAOB
SCHEMBL25442765 0.77 CYP3A4 (0.59) CYP3A4CYP2D6CYP2C9MAOAMAOB
SCHEMBL28949296 0.77 CYP3A4 (0.44) CYP3A4CYP2D6CYP2C9HSP90AA1HSP90AB1
SCHEMBL4508766 0.74 GRM5 (0.49) CYP3A4CYP2D6CYP2C9MAPTPOLB
SCHEMBL28949310 0.72 CYP3A4 (0.43) CYP3A4CYP2D6CYP2C9HSP90AA1HSP90AB1
SCHEMBL26662266 0.72 MAOA (0.43) CYP3A4CYP2D6CYP2C9MAPTMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR FUKANG (SHANGHAI) HEALTH TECHNOLOGY CO., LTD (CN) 2024-01-18 US disclosed
US-20230015617-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2023-01-19 US disclosed
US-11160803-B2 Phthalazinone derivatives KUDOS PHARMACEUTICALS LIMITED (GB) 2021-11-02 US disclosed
US-10449192-B2 Phthalazinone derivatives KUDO PHARMACEUTICALS LIMITED (GB) 2019-10-22 US disclosed
US-20180185363-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2018-07-05 US disclosed
US-20170226124-A1 PHTHALAZINONE DERIVATIVES KUDOS PHARMACEUTICALS LIMITED (GB) 2017-08-10 US disclosed
US-9566276-B2 Phthalazinone derivatives KUDOS PHARMACEUTICALS LIMITED (GB) 2017-02-14 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 (6 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-20170226124-A1 PHTHALAZINONE DERIVATIVES NR0B1, NR0B2, NR2E1 CYP3A4 1535/4885CYP2D6 1395/4885CYP2C9 1361/4885
US-10449192-B2 Phthalazinone derivatives NR0B1, NR0B2, NR2E1 CYP3A4 1499/4885CYP2D6 1407/4885CYP2C9 1357/4885
US-11160803-B2 Phthalazinone derivatives NR0B1, NR0B2, NR2E1 CYP3A4 1499/4885CYP2D6 1407/4885CYP2C9 1357/4885
US-20240016775-A1 ANTI-CORONAVIRUS APPLICATION OF POLY ADP RIBOSE POLYMERASE INHIBITOR PARP3, PARP1, PARP4 CYP3A4 2004/4885CYP2D6 3250/4885CYP2C9 3706/4885
US-20230015617-A1 PHTHALAZINONE DERIVATIVES NR0B1, NR0B2, NR2E1 CYP3A4 1535/4885CYP2D6 1395/4885CYP2C9 1361/4885
US-20180185363-A1 PHTHALAZINONE DERIVATIVES NR0B1, NR0B2, NR2E1 CYP3A4 1499/4885CYP2D6 1407/4885CYP2C9 1357/4885

“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.