SCHEMBL20116112

SCHEMBL20116112

COc1ccc(-c2coc(C3CCN(C(=O)CNC(=O)c4ccccc4)CC3)n2)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.50
PREP P48147 1/20 0.47
MAPT P10636 1/20 0.47
POLB P06746 1/20 0.46
LDHA P00338 1/20 0.45
SMO Q99835 1/20 0.44
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TLR9 Q9NR96 1/20 0.42
TLR8 Q9NR97 1/20 0.42
TLR7 Q9NYK1 1/20 0.42
P2RY12 Q9H244 1/20 0.42
KMT2A Q03164 1/20 0.41
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41

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
SCHEMBL30506331 1.00 SMN1; SMN2 (0.50) SMN1; SMN2PREPMAPTPOLBLDHA
SCHEMBL30720960 0.86 SMO (0.57) SMN1; SMN2LDHASMOKMT2A
SCHEMBL20116462 0.86 SMO (0.57) SMN1; SMN2LDHASMOKMT2A
SCHEMBL20661039 0.84 SMN1; SMN2 (0.45) SMN1; SMN2LDHASMOP2RY12KMT2A
SCHEMBL20116128 0.84 TLR8 (0.59) SMN1; SMN2PREPMAPTPOLBTLR9
SCHEMBL30506325 0.83 MAPT (0.51) SMN1; SMN2PREPMAPTPOLBLDHA
SCHEMBL20116116 0.83 MAPT (0.51) SMN1; SMN2PREPMAPTPOLBLDHA
SCHEMBL22357815 0.83 PREP (0.53) SMN1; SMN2PREPMAPTPOLBLDHA
SCHEMBL22358095 0.82 SMO (0.53) SMN1; SMN2POLBLDHASMOTLR9
SCHEMBL22357830 0.81 SMO (0.52) SMN1; SMN2LDHASMOKMT2A

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-117777121-A Compounds and uses thereof 詹森药业有限公司 2024-03-29 CN disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
CN-110099898-B Compounds and uses thereof 优曼尼蒂治疗公司 2023-07-25 CN disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 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 (2 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 SMN1; SMN2 13/4885PREP 677/4885MAPT 22/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 SMN1; SMN2 13/4885PREP 677/4885MAPT 22/4885

“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.