SCHEMBL2426591

SCHEMBL2426591

FC(F)(F)c1cc(Br)c2[nH]ncc2c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 8/20 0.46
▸ NOS1 P29475 3/20 0.46
▸ S1PR1 P21453 3/20 0.39
▸ TRPA1 O75762 1/20 0.38
▸ PTPN6 P29350 1/20 0.37
▸ CYP1A2 P05177 4/20 0.36
▸ RXRA P19793 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ RXRG P48443 1/20 0.35
▸ CSNK2A1 P68400 1/20 0.34
▸ DYRK1A Q13627 1/20 0.34
▸ RIPK1 Q13546 1/20 0.34
▸ TDO2 P48775 2/20 0.33
▸ AXL P30530 1/20 0.33
▸ EGLN1 Q9GZT9 1/20 0.33
▸ IDO1 P14902 1/20 0.33

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
SCHEMBL18299189 0.80 TRPA1 (0.56) METAP2S1PR1TRPA1CYP1A2RXRA
SCHEMBL13961150 0.80 METAP2 (0.47) METAP2NOS1S1PR1TRPA1CYP1A2
SCHEMBL28954103 0.79 METAP2 (0.46) METAP2S1PR1TRPA1CYP1A2RXRA
SCHEMBL2425031 0.77 NOS1 (0.52) METAP2NOS1TRPA1CSNK2A1DYRK1A
SCHEMBL11577531 0.75 NOS1 (0.53) METAP2NOS1CSNK2A1DYRK1ATDO2
SCHEMBL2426106 0.75 METAP2 (0.42) METAP2S1PR1TRPA1CYP1A2RXRA
SCHEMBL28811084 0.75 METAP2 (0.42) METAP2S1PR1TRPA1CYP1A2RXRA
SCHEMBL31404481 0.73 RXRA (0.43) METAP2S1PR1RXRARXRBRXRG
SCHEMBL30726242 0.73 EGLN1 (0.35) RIPK1EGLN1
SCHEMBL27033392 0.73 EGLN1 (0.35) RIPK1EGLN1

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
EP-4650345-A1 HETEROCYCLIC COMPOUND AND USE THEREOF IN MEDICINE Kangbaida (Sichuan) Biotechnology Co., Ltd. (CN) 2025-11-19 — — EP disclosed
WO-2025045837-A1 PESTICIDALLY ACTIVE INDAZOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2025-03-06 — — WO disclosed
WO-2024149242-A1 HETEROCYCLIC COMPOUND AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2024-07-18 — — WO disclosed
US-8026257-B2 Substituted heterocyclic ethers and their use in CNS disorders BRISTOL-MYERS SQUIBB COMPANY (US) 2011-09-27 — — US disclosed
US-8026257-B2 Substituted heterocyclic ethers and their use in CNS disorders BRISTOL-MYERS SQUIBB COMPANY (US) 2011-09-27 — — US disclosed
US-8026257-B2 Substituted heterocyclic ethers and their use in CNS disorders BRISTOL-MYERS SQUIBB COMPANY (US) 2011-09-27 — — US disclosed
US-20090018132-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders BRISTOL-MYERS SQUIBB COMPANY 2009-01-15 — — US disclosed
US-20090018132-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders BRISTOL-MYERS SQUIBB COMPANY 2009-01-15 — — US disclosed
US-20090018132-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders BRISTOL-MYERS SQUIBB COMPANY 2009-01-15 — — US disclosed
WO-2009009411-A1 SUBSTITUTED HETEROCYCLIC ETHERS AND THEIR USE IN CNS DISORDERS BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-15 — — 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 (1 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-20090018132-A1 Substituted Heterocyclic Ethers and Their Use in CNS Disorders CNR1, CNR2, PMP22 METAP2 4656/4885NOS1 4422/4885S1PR1 1406/4885

“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.

Send feedback