SCHEMBL18889231

SCHEMBL18889231

O=C(O)c1cc2c(Cc3ccc(F)cc3F)cccc2s1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 2/20 0.44
AURKA O14965 2/20 0.44
DAPK3 O43293 2/20 0.44
CHEK2 O96017 2/20 0.44
CDK1 P06493 2/20 0.44
PIM1 P11309 2/20 0.44
CDK2 P24941 2/20 0.44
FLT4 P35916 2/20 0.44
KDR P35968 2/20 0.44
MAPK9 P45984 2/20 0.44
CSNK1D P48730 2/20 0.44
GSK3A P49840 2/20 0.44
GSK3B P49841 2/20 0.44
PLK1 P53350 2/20 0.44
DYRK1A Q13627 2/20 0.44
AURKB Q96GD4 2/20 0.44
PLK3 Q9H4B4 2/20 0.44
CSNK2A1 P68400 1/20 0.44
PIM2 Q9P1W9 1/20 0.44
SLC9A1 P19634 9/20 0.42

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
SCHEMBL18889197 0.84 PLK4 (0.43) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL18889283 0.83 PLK4 (0.48) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL18889233 0.80 RIPK1 (0.70) RIPK1ALDH1A1POLBL3MBTL1
SCHEMBL18889245 0.78 PLK4 (0.43) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL2893037 0.77 SLC9A1 (0.62) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL9432801 0.76 SLC9A1 (0.50) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL18889268 0.74 TP53 (0.45) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL18889267 0.71 SLC9A1 (0.68) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL5584978 0.71 SLC9A1 (0.49) PLK4AURKADAPK3CHEK2CDK1
SCHEMBL18889277 0.71 ICAM1 (0.43) PLK4AURKADAPK3CHEK2CDK1

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
EP-3176163-B1 NOVEL INDENE DERIVATIVE, PREPARATION METHOD FOR SAME, AND PHARMACEUTICAL COMPOSITION, FOR PREVENTING OR TREATING RETINAL DISEASES, CONTAINING SAME AS ACTIVE INGREDIENT IAC IN NAT UNIV CHUNGNAM (KR) 2019-04-17 EP disclosed
EP-3176163-A1 NOVEL INDENE DERIVATIVE, PREPARATION METHOD FOR SAME, AND PHARMACEUTICAL COMPOSITION, FOR PREVENTING OR TREATING RETINAL DISEASES, CONTAINING SAME AS ACTIVE INGREDIENT The Industry & Academic Cooperation in Chungnam National University (IAC) (KR) 2017-06-07 EP disclosed
US-20170152268-A1 NOVEL INDENE DERIVATIVE, PREPARATION METHOD FOR SAME, AND PHARMACEUTICAL COMPOSITION, FOR PREVENTING OR TREATING RETINAL DISEASES, CONTAINING SAME AS ACTIVE INGREDIENT MOTHER'S PHARMACEUTICAL CO., LTD. (KR) 2017-06-01 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-20170152268-A1 NOVEL INDENE DERIVATIVE, PREPARATION METHOD FOR SAME, AND PHARMACEUTICAL COMPOSITION, FOR PREVENTING OR TREATING RETINAL DISEASES, CONTAINING SAME AS ACTIVE INGREDIENT RIPK1, RIPK2, RIPK3 PLK4 1017/4885AURKA 389/4885DAPK3 35/4885

“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.