SCHEMBL21551229

SCHEMBL21551229

CC(C)(CNc1ccc(Br)cn1)NC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
RAB9A P51151 9/20 0.46
NPC1 O15118 7/20 0.45
TP53 P04637 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
PKM P14618 1/20 0.43
ALDH1A1 P00352 3/20 0.42
GAA P10253 1/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
MAPT P10636 1/20 0.41
HCAR3 P49019 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
SCHEMBL21564436 0.83 LATS1 (0.43) TSHRRAB9ANPC1SMN1; SMN2PKM
SCHEMBL29890985 0.83 LATS1 (0.43) TSHRRAB9ANPC1SMN1; SMN2PKM
SCHEMBL12932912 0.81 NPC1 (0.49) TSHRRAB9ANPC1TP53MAPK1
SCHEMBL1435912 0.76 NPC1 (0.46) TSHRRAB9ANPC1MAPK1SMN1; SMN2
SCHEMBL28546897 0.76 RAB9A (0.43) TSHRRAB9ANPC1TP53MAPK1
SCHEMBL29168041 0.75 ALDH1A1 (0.39) TSHRRAB9ANPC1TP53MAPK1
SCHEMBL23321251 0.74 TSHR (0.59) TSHRRAB9ANPC1SMN1; SMN2PKM
SCHEMBL4479092 0.74 TSHR (0.55) TSHRRAB9ANPC1TP53MAPK1
SCHEMBL28543777 0.73 RAB9A (0.40) TSHRRAB9ANPC1TP53MAPK1
SCHEMBL17253048 0.73 NPC1 (0.47) TSHRRAB9ANPC1MAPK1SMN1; SMN2

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
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-20220315556-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-10-06 US disclosed
EP-3790871-A1 FURIN INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2021-03-17 EP disclosed
WO-2019215341-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-11-14 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-20220315556-A1 FURIN INHIBITORS FURIN, TGFB1, PCSK7 TSHR 3953/4885RAB9A 352/4885NPC1 250/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 TSHR 3953/4885RAB9A 352/4885NPC1 250/4885

“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.