SCHEMBL24689985

SCHEMBL24689985

COc1ccc(CNc2cc(-c3nnn[nH]3)cc(Oc3ccccc3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGDR Q13258 1/20 0.44
▸ HRH1 P35367 2/20 0.44
▸ HRH4 Q9H3N8 2/20 0.44
▸ MAPT P10636 5/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CLK4 Q9HAZ1 4/20 0.42
▸ DYRK1A Q13627 2/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HTT P42858 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ ACP1 P24666 1/20 0.41
▸ BTK Q06187 1/20 0.40
▸ CDC7 O00311 1/20 0.40
▸ DAPK3 O43293 1/20 0.40
▸ ROCK2 O75116 1/20 0.40

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
SCHEMBL24690088 0.90 MAPT (0.45) PTGDRHRH1HRH4MAPTCLK4
SCHEMBL24689861 0.86 HRH1 (0.55) PTGDRHRH1HRH4MAPTCLK4
SCHEMBL24689862 0.83 MAPT (0.45) PTGDRHRH1HRH4MAPTCLK4
SCHEMBL30019455 0.76 HTT (0.57) PTGDRHRH1HRH4MAPTCYP1A2
SCHEMBL24690170 0.76 HTT (0.57) PTGDRHRH1HRH4MAPTCYP1A2
SCHEMBL2144558 0.74 CLK4 (0.53) PTGDRMAPTCYP1A2CYP2C19CYP2C9
SCHEMBL30019977 0.72 BCAT2 (0.42) MAPTCYP1A2CYP2C19CYP2C9ALDH1A1
SCHEMBL24689984 0.72 BCAT2 (0.42) MAPTCYP1A2CYP2C19CYP2C9ALDH1A1
SCHEMBL29151881 0.71 HPGD (0.32) MAPTCYP1A2CYP2C19CYP2C9ALDH1A1
SCHEMBL3117278 0.70 APP (0.60) MAPTCYP1A2CYP2C19CYP2C9CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240254093-A1 GPR35 Agonist Compounds NXERA PHARMA UK LIMITED (GB) 2024-08-01 — — US disclosed
EP-4326708-A1 GPR35 AGONIST COMPOUNDS Heptares Therapeutics Limited (GB) 2024-02-28 — — EP disclosed
CN-117529472-A GPR35 agonist compounds 赫普泰雅治疗有限公司 2024-02-06 — — CN disclosed
WO-2022224212-A1 GPR35 AGONIST COMPOUNDS HEPTARES THERAPEUTICS LIMITED (GB) 2022-10-27 — — WO disclosed
WO-2022224212-A1 GPR35 AGONIST COMPOUNDS HEPTARES THERAPEUTICS LIMITED (GB) 2022-10-27 — — 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-20240254093-A1 GPR35 Agonist Compounds GPR35, GPR119, GPR68 PTGDR 310/4885HRH1 637/4885HRH4 609/4885

“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