SCHEMBL22466254

SCHEMBL22466254

CC1(C)COC(c2cc(C(=O)Nc3ccc(N4CCC(C)(C)C4)cc3)cc(F)c2O)OC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 10/20 0.41
▸ NPC1 O15118 9/20 0.41
▸ MAPT P10636 8/20 0.41
▸ SMN1; SMN2 Q16637 7/20 0.41
▸ TP53 P04637 4/20 0.41
▸ TSHR P16473 1/20 0.41
▸ HTT P42858 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ SNCA P37840 2/20 0.39
▸ HDAC3 O15379 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ KCNQ3 O43525 1/20 0.37
▸ KCNQ2 O43526 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
SCHEMBL29377974 1.00 RAB9A (0.41) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL22465944 0.87 BRD4 (0.40) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL22465943 0.87 BRD4 (0.40) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL22466021 0.85 BRD4 (0.38) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL22466101 0.85 BRD4 (0.38) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL22465932 0.81 KCNQ3 (0.51) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL29377113 0.81 KCNQ3 (0.51) RAB9ANPC1MAPTSMN1; SMN2HTT
SCHEMBL22466162 0.80 RAB9A (0.44) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL22465920 0.80 P2RY1 (0.40) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL22465929 0.77 SNCA (0.38) RAB9ANPC1MAPTSMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-114025847-A Compounds and compositions as modulators of TLR signaling 神经孔疗法股份有限公司 2022-02-08 — — CN 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

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 RAB9A 3141/4885NPC1 652/4885MAPT 100/4885
US-20200308163-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 RAB9A 3141/4885NPC1 652/4885MAPT 100/4885
US-11299487-B2 Compounds and compositions as modulators of TLR signaling TLR3, TLR6, TLR4 RAB9A 2725/4885NPC1 675/4885MAPT 124/4885

“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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