SCHEMBL19434591

SCHEMBL19434591

COC(=O)c1ccc(COCCO)n1C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPK1 P28482 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CYP4A11 Q02928 4/20 0.35
CYP4F2 P78329 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
RAB9A P51151 2/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CXCL8 P10145 1/20 0.33
AKR1B1 P15121 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
GLO1 Q04760 1/20 0.33

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
SCHEMBL19434539 0.84 NPSR1 (0.50) NPC1NPSR1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL2175952 0.80 NPC1 (0.44) NPC1NPSR1KDM4EMAPK1ATM
SCHEMBL2176691 0.76 LOXL2 (0.44) NPC1NPSR1KDM4EMAPK1ATM
SCHEMBL19434614 0.75 L3MBTL1 (0.38) NPC1L3MBTL1ALDH1A1SMN1; SMN2RAB9A
SCHEMBL69407 0.74 KDM4E (0.53) NPC1NPSR1KDM4EMAPK1ATM
SCHEMBL19434672 0.72 MEN1 (0.41) NPC1MAPK1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL1627925 0.71 CYP4A11 (0.60) NPC1KDM4EMAPK1L3MBTL1ALDH1A1
SCHEMBL19434537 0.70 NPSR1 (0.47) NPC1NPSR1MAPK1L3MBTL1ALDH1A1
SCHEMBL21448919 0.70 NPC1 (0.46) NPC1NPSR1KDM4EMAPK1ATM
SCHEMBL21538909 0.69 CXCL8 (0.36) CXCL8AKR1B1PTGS1PTGS2GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3440073-B1 KINASE INHIBITORS OXULAR ACQUISITIONS LTD (GB) 2022-06-08 EP disclosed
US-10442828-B2 Kinase inhibitors TOPIVERT PHARMA LIMITED (GB) 2019-10-15 US disclosed
EP-3440073-A1 KINASE INHIBITORS Topivert Pharma Limited (GB) 2019-02-13 EP disclosed
US-20180305383-A1 KINASE INHIBITORS OXULAR ACQUISITIONS LIMITED (GB) 2018-10-25 US disclosed
US-10072034-B2 Kinase inhibitors RESPIVERT LIMITED (GB) 2018-09-11 US disclosed
US-20170291917-A1 KINASE INHIBITORS OXULAR ACQUISITIONS LIMITED (GB) 2017-10-12 US disclosed
WO-2017174995-A1 KINASE INHIBITORS RESPIVERT LIMITED (GB) 2017-10-12 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 (4 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-10072034-B2 Kinase inhibitors SYK, LYN, BTK NPC1 4825/4885NPSR1 1649/4885KDM4E 2053/4885
US-20180305383-A1 KINASE INHIBITORS SYK, LTK, LTB4R NPC1 4645/4885NPSR1 1074/4885KDM4E 2216/4885
US-10442828-B2 Kinase inhibitors SYK, LTK, LTB4R NPC1 4645/4885NPSR1 1074/4885KDM4E 2216/4885
US-20170291917-A1 KINASE INHIBITORS SYK, LYN, BTK NPC1 4825/4885NPSR1 1649/4885KDM4E 2053/4885

“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.