SCHEMBL2549110

SCHEMBL2549110

O=c1[nH]c2ccccc2c2c(O)csc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS O95271 2/20 0.58
TNKS2 Q9H2K2 2/20 0.58
KDM4E B2RXH2 7/20 0.50
ALDH1A1 P00352 5/20 0.50
MAPT P10636 4/20 0.50
IDE P14735 1/20 0.50
MPI P34949 1/20 0.50
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
DAO P14920 1/20 0.46
DDO Q99489 1/20 0.46
IMPDH2 P12268 1/20 0.46
IMPDH1 P20839 1/20 0.46
CYP1A2 P05177 2/20 0.46
PPARG P37231 1/20 0.46
HTT P42858 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
Hydrochloric Acid SCHEMBL2553173 0.98 TNKS (0.56) TNKSTNKS2KDM4EALDH1A1MAPT
SCHEMBL2564831 0.81 CHEK1 (0.47) TNKS2MEN1KMT2APARP1PARP15
SCHEMBL2553122 0.81 TNKS2 (0.54) TNKSTNKS2KDM4EALDH1A1MAPT
SCHEMBL2544993 0.80 TNKS (0.47) TNKSTNKS2KDM4EALDH1A1MAPT
Hydrochloric Acid SCHEMBL14672733 0.79 TNKS2 (0.53) TNKSTNKS2KDM4EALDH1A1MAPT
Bromide SCHEMBL16858709 0.79 TNKS2 (0.53) TNKSTNKS2KDM4EALDH1A1MAPT
Hydrochloric Acid SCHEMBL15092541 0.79 TNKS (0.46) TNKSTNKS2KDM4EALDH1A1MAPT
Hydrochloric Acid SCHEMBL2571837 0.77 TNKS (0.50) TNKSTNKS2KDM4EALDH1A1MAPT
SCHEMBL2553281 0.77 CYP1A2 (0.52) TNKSTNKS2KDM4EALDH1A1MAPT
Hydrochloric Acid SCHEMBL2550916 0.77 TNKS (0.50) TNKSTNKS2KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9453025-B2 Tricyclic compounds and PBK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2016-09-27 US disclosed
US-20150183799-A1 Tricyclic Compounds and PBK Inhibitors Containing the Same ONCOTHERAPY SCIENCE INC (JP) 2015-07-02 US disclosed
US-8962648-B2 Tricyclic compounds and PBK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2015-02-24 US disclosed
US-20130178459-A1 TRICYCLIC COMPOUNDS AND PBK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2013-07-11 US disclosed
WO-2011123419-A1 TRYCYCLIC COMPOUNDS AND PBK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2011-10-06 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 (2 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-20130178459-A1 TRICYCLIC COMPOUNDS AND PBK INHIBITORS CONTAINING THE SAME PBDC1, SBK1, PLK2 TNKS 44/4885TNKS2 33/4885KDM4E 1734/4885
US-20150183799-A1 Tricyclic Compounds and PBK Inhibitors Containing the Same PBDC1, SBK1, PLK2 TNKS 44/4885TNKS2 33/4885KDM4E 1734/4885

“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.