SCHEMBL18313849

SCHEMBL18313849

N=c1ccccn1CC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.60
▸ RAB9A P51151 3/20 0.60
▸ NPC1 O15118 1/20 0.60
▸ NR2F2 P24468 1/20 0.60
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ MGAM O43451 1/20 0.49
▸ AMY1A P0DUB6 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ SI P14410 1/20 0.49
▸ MGAM2 Q2M2H8 1/20 0.49
▸ L3MBTL1 Q9Y468 3/20 0.49
▸ PTPN1 P18031 1/20 0.49
▸ GSK3B P49841 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ FFAR1 O14842 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ F10 P00742 2/20 0.47
▸ F2 P00734 1/20 0.47

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
SCHEMBL20042582 0.83 SMN1; SMN2 (0.56) KDM4ERAB9ANPC1NR2F2SMN1; SMN2
SCHEMBL3719707 0.78 KDM4E (0.53) KDM4EL3MBTL1MAPTLMNAHPGD
SCHEMBL5154435 0.78 CXCR3 (0.54) KDM4ERAB9ANPC1MGAMAMY1A
SCHEMBL13779317 0.78 RAB9A (0.65) KDM4ERAB9ANPC1NR2F2SMN1; SMN2
SCHEMBL29520514 0.76 KDM4E (0.97) KDM4ERAB9ANPC1NR2F2SMN1; SMN2
SCHEMBL15030329 0.75 SMN1; SMN2 (0.51) KDM4ERAB9ANPC1NR2F2SMN1; SMN2
SCHEMBL17830465 0.75 MAPT (0.53) KDM4ERAB9ANPC1NR2F2SMN1; SMN2
SCHEMBL8399585 0.72 SMN1; SMN2 (0.51) KDM4ERAB9ANPC1NR2F2SMN1; SMN2
SCHEMBL10656937 0.71 TSHR (0.59) KDM4ERAB9ASMN1; SMN2MGAMAMY1A
SCHEMBL27182280 0.69 ERCC5 (0.77) KDM4ERAB9ANPC1SMN1; SMN2L3MBTL1

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-20230149399-A1 TREATMENT OF CANCER, INFLAMMATORY DISEASES AND AUTOIMMUNE DISEASES USHER III INITIATIVE, INC. 2023-05-18 — — US disclosed
US-20230149399-A1 TREATMENT OF CANCER, INFLAMMATORY DISEASES AND AUTOIMMUNE DISEASES USHER III INITIATIVE, INC. 2023-05-18 — — US disclosed
EP-3307742-B1 METHODS OF TREATING OR PREVENTING A PROTEOPATHY USHER III INITIATIVE INC (US) 2022-05-18 — — EP disclosed
WO-2022011091-A1 TREATMENT OF CANCER, INFLAMMATORY DISEASES AND AUTOIMMUNE DISEASES USHER III INITIATIVE, INC. (US) 2022-01-13 — — WO disclosed
WO-2016201266-A1 METHODS OF TREATING OR PREVENTING A PROTEOPATHY USHER III INITIATIVE, INC. (US) 2016-12-15 — — 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-20230149399-A1 TREATMENT OF CANCER, INFLAMMATORY DISEASES AND AUTOIMMUNE DISEASES TNF, HLA-DRB1, GSTK1 KDM4E 2203/4885RAB9A 2304/4885NPC1 1858/4885

“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