SCHEMBL22465920

SCHEMBL22465920

CC1(C)COC(c2cc(C(=O)Nc3ccc(N4CCOc5ccccc54)cc3)cc(F)c2O)OC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 1/20 0.40
▸ GRM1 Q13255 1/20 0.40
▸ HTR1A P08908 1/20 0.39
▸ HTR1D P28221 1/20 0.39
▸ HTR1F P30939 1/20 0.39
▸ MAOB P27338 3/20 0.38
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ MAPT P10636 6/20 0.36
▸ LMNA P02545 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ TNF P01375 1/20 0.36
▸ NOD2 Q9HC29 1/20 0.36
▸ NOD1 Q9Y239 1/20 0.36
▸ KDM1A O60341 2/20 0.36
▸ MAOA P21397 2/20 0.36
▸ RCOR1 Q9UKL0 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.35

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
SCHEMBL22465992 0.80 P2RY1 (0.42) P2RY1GRM1MAOBNPC1RAB9A
SCHEMBL29377974 0.80 RAB9A (0.41) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL22466254 0.80 RAB9A (0.41) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL22465943 0.79 BRD4 (0.40) HTR1FNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL22465944 0.79 BRD4 (0.40) HTR1FNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL22466101 0.77 BRD4 (0.38) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL22466021 0.77 BRD4 (0.38) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL22465932 0.74 KCNQ3 (0.51) NPC1RAB9ASMN1; SMN2KMT2AMAPT
SCHEMBL29377113 0.74 KCNQ3 (0.51) NPC1RAB9ASMN1; SMN2KMT2AMAPT
SCHEMBL22465929 0.71 SNCA (0.38) NPC1RAB9ASMN1; SMN2KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114025847-B Compounds and compositions as modulators of TLR signaling 神经孔疗法股份有限公司 2024-05-24 — — CN disclosed
US-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2022-09-22 — — US disclosed
US-11299487-B2 Compounds and compositions as modulators of TLR signaling NEUROPORE THERAPIES, INC. (US) 2022-04-12 — — US disclosed
EP-3946599-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING Neuropore Therapies, Inc. (US) 2022-02-09 — — EP disclosed
WO-2020198368-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2020-10-01 — — WO disclosed
WO-2020198368-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2020-10-01 — — WO disclosed
US-20200308163-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2020-10-01 — — US disclosed
US-20200308163-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2020-10-01 — — 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 (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-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 P2RY1 1035/4885GRM1 110/4885HTR1A 2684/4885
US-20200308163-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 P2RY1 1035/4885GRM1 110/4885HTR1A 2684/4885
US-11299487-B2 Compounds and compositions as modulators of TLR signaling TLR3, TLR6, TLR4 P2RY1 1197/4885GRM1 108/4885HTR1A 1926/4885

“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.

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