SCHEMBL16015332

SCHEMBL16015332

Cc1cc(COc2cc(OCc3cc(OCc4ccccc4)c(OCc4ccccc4)c(OCc4ccccc4)c3)cc(C(=O)N/N=C/c3c4ccccc4cc4ccccc34)c2)cc(OCc2ccccc2)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.48
SPHK2 Q9NRA0 2/20 0.44
SPHK1 Q9NYA1 2/20 0.44
KMT2A Q03164 7/20 0.43
KDM4E B2RXH2 6/20 0.43
MEN1 O00255 5/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 7/20 0.43
ALDH1A1 P00352 5/20 0.42
HPGD P15428 4/20 0.42
RAB9A P51151 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
HTT P42858 2/20 0.42
ADCYAP1R1 P41586 1/20 0.42
POLB P06746 4/20 0.41
RAD52 P43351 1/20 0.41
RECQL P46063 1/20 0.41
THRB P10828 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL16015341 0.97 SPHK2 (0.46) PTGESSPHK2SPHK1KMT2AKDM4E
SCHEMBL16015337 0.95 PTGES (0.53) PTGESSPHK2SPHK1KMT2AKDM4E
SCHEMBL16015331 0.93 PTGES (0.51) PTGESSPHK2SPHK1KMT2AKDM4E
SCHEMBL16267756 0.88 PTGES (0.60) PTGESSPHK2SPHK1KMT2AKDM4E
SCHEMBL16267757 0.88 PTGES (0.60) PTGESSPHK2SPHK1KMT2AKDM4E
SCHEMBL16267276 0.86 KMT2A (0.55) SPHK2SPHK1KMT2AKDM4EMEN1
SCHEMBL16267275 0.86 KMT2A (0.55) SPHK2SPHK1KMT2AKDM4EMEN1
SCHEMBL16015329 0.86 PTGES (0.62) PTGESSPHK2SPHK1KMT2AKDM4E
SCHEMBL16015338 0.86 KMT2A (0.57) SPHK2SPHK1KMT2AKDM4EMEN1
SCHEMBL16015334 0.85 PTGES (0.55) PTGESSPHK2SPHK1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9201001-B2 Visual detection of fluoride ions INDIAN INSTITUTE OF TECHNOLOGY MADRAS (IN) 2015-12-01 US disclosed
US-20140357894-A1 VISUAL DETECTION OF FLUORIDE IONS EMPIRE TECHNOLOGY DEVELOPMENT LLC 2014-12-04 US disclosed
US-8828735-B2 Visual detection of fluoride ions INDIAN INSTITUTE OF TECHNOLOGY MADRAS (IN) 2014-09-09 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-20140357894-A1 VISUAL DETECTION OF FLUORIDE IONS HNRNPL, HNRNPLL, ARAF PTGES 3388/4885SPHK2 872/4885SPHK1 1117/4885

“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.