SCHEMBL22609113

SCHEMBL22609113

COC(=O)c1c(N)nc2n1CCC2

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.56
HSD17B10 Q99714 4/20 0.56
HTT P42858 2/20 0.56
POLB P06746 3/20 0.50
ALDH1A1 P00352 6/20 0.43
DAPK3 O43293 1/20 0.41
JAK2 O60674 1/20 0.41
PRKD3 O94806 1/20 0.41
MAP4K4 O95819 1/20 0.41
ABL1 P00519 1/20 0.41
CSF1R P07333 1/20 0.41
RET P07949 1/20 0.41
MET P08581 1/20 0.41
PDGFRA P16234 1/20 0.41
PRKACA P17612 1/20 0.41
LTK P29376 1/20 0.41
GRK5 P34947 1/20 0.41
KDR P35968 1/20 0.41
MAPK8 P45983 1/20 0.41
MAPK9 P45984 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
SCHEMBL31714775 0.84 POLB (0.67) MAPK1HSD17B10HTTPOLBALDH1A1
SCHEMBL3738019 0.80 POLB (0.62) MAPK1HSD17B10HTTPOLBALDH1A1
SCHEMBL13041017 0.78 MAPK1 (0.64) MAPK1HSD17B10HTTPOLBALDH1A1
SCHEMBL13772455 0.76 HSD17B10 (0.60) MAPK1HSD17B10HTTPOLBALDH1A1
SCHEMBL13738891 0.73 THRB (0.42) MAPK1HSD17B10HTTPOLBALDH1A1
SCHEMBL29724048 0.71 TGFBR1 (0.57) MAPK1HSD17B10HTTPOLBALDH1A1
SCHEMBL1750234 0.70 MAPT (0.45) MAPK1HSD17B10POLBALDH1A1THRB
SCHEMBL6122317 0.69 MAPK1 (0.70) MAPK1HSD17B10HTTPOLBALDH1A1
SCHEMBL10185314 0.67 MAPK1 (0.43) MAPK1HTTPOLBALDH1A1THRB
SCHEMBL24265362 0.66 TP53 (0.54) THRBKDM4EMAPTLMNAL3MBTL1

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
US-20200369618-A1 ASYMMETRIC DERIVATIVES OF POLYPHENOLS OF THE DINAPHTHALINE SERIES, PROCESS OF PREPARING AND USE THEREOF Nearmedic International Limited (CY) 2020-11-26 US disclosed
EP-3731933-A1 ASYMMETRIC DERIVATIVES OF POLYPHENOLS OF THE DINAPHTHALINE SERIES, PROCESS OF PREPARING AND USE THEREOF Nearmedic International Limited (CY) 2020-11-04 EP 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-20200369618-A1 ASYMMETRIC DERIVATIVES OF POLYPHENOLS OF THE DINAPHTHALINE SERIES, PROCESS OF PREPARING AND USE THEREOF DNM2, DNM1, MAVS MAPK1 2752/4885HSD17B10 980/4885HTT 2135/4885

“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.