SCHEMBL5279682

SCHEMBL5279682

O=C(Cn1ncc2ccccc21)Oc1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.50
TSHR P16473 3/20 0.50
HSD17B10 Q99714 3/20 0.50
KMO O15229 1/20 0.49
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
RECQL P46063 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.44
CYP1A2 P05177 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
SYK P43405 1/20 0.38

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
SCHEMBL4300707 0.81 NPC1 (0.56) POLBTSHRHSD17B10KMONPC1
SCHEMBL3626813 0.79 HSD17B10 (0.67) POLBTSHRHSD17B10KMONPC1
SCHEMBL31602755 0.79 HSD17B10 (0.67) POLBTSHRHSD17B10KMONPC1
SCHEMBL5281382 0.78 KDM4E (0.52) POLBTSHRHSD17B10KMONPC1
SCHEMBL15859288 0.78 NPC1 (0.55) POLBTSHRHSD17B10KMONPC1
SCHEMBL8999792 0.76 KMO (0.59) POLBTSHRHSD17B10KMONPC1
SCHEMBL5281090 0.76 GAA (0.58) POLBHSD17B10NPC1RAB9AL3MBTL1
SCHEMBL5283492 0.75 KMT2A (0.56) TSHRHSD17B10NPC1RAB9ASMN1; SMN2
SCHEMBL17665507 0.75 MEN1 (0.58) POLBTSHRHSD17B10KMONPC1
SCHEMBL3374171 0.75 KMO (0.71) POLBTSHRHSD17B10KMONPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 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 (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-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 POLB 3888/4885TSHR 4292/4885HSD17B10 3639/4885

“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.