SCHEMBL8229673

SCHEMBL8229673

CCCc1ccc2nsnc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 4/20 0.45
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
PTPN1 P18031 2/20 0.41
KDM4E B2RXH2 3/20 0.40
GAA P10253 2/20 0.40
HSD17B10 Q99714 1/20 0.40
TXNRD1 Q16881 1/20 0.39
TXNRD3 Q86VQ6 1/20 0.39
TXNRD2 Q9NNW7 1/20 0.39
ALDH1A1 P00352 3/20 0.37
PPARG P37231 1/20 0.37
NCOA2 Q15596 1/20 0.37
NCOA1 Q15788 1/20 0.37
MAPT P10636 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
LMNA P02545 2/20 0.37
BLM P54132 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37

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
SCHEMBL257319 0.83 PTPN11 (0.48) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL5654842 0.82 ALDH1A1 (0.47) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL14944883 0.80 PTPN11 (0.55) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL22900317 0.79 PTPN11 (0.41) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL12595077 0.78 PTPN11 (0.48) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL25107120 0.75 LMNA (0.40) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL5262949 0.75 PTPN11 (0.48) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL245270 0.75 PTPN11 (0.48) PTPN11PTPN1KDM4EGAAHSD17B10
SCHEMBL3275924 0.75 PTPN11 (0.54) PTPN11PTPN1KDM4EGAATXNRD1
SCHEMBL4682270 0.75 PTPN11 (0.48) PTPN11PTPN1KDM4EGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230112086-A1 PHOTO-CLEAVABLE PRIMER COMPOSITIONS AND METHODS OF USE ORMCO CORPORATION 2023-04-13 US disclosed
US-11453790-B2 Photo-cleavable primer compositions and methods of use ENVISTA (US) 2022-09-27 US disclosed
US-20200347248-A1 PHOTO-CLEAVABLE PRIMER COMPOSITIONS AND METHODS OF USE ENVISTA (US) 2020-11-05 US disclosed
US-7902373-B2 asthma; for treating prostaglandin D2 mediated diseases; e.g. 6-(3-fluorophenyl)-N-[1-(1-methyl-1H-tetrazol-5-yl)piperidin-4-yl]nicotinamide PFIZER INC (US) 2011-03-08 US disclosed
US-20100041618-A1 6-11 Bridged Oxime Erythromycin Derivatives ENANTA PHARMACEUTICALS, INC. 2010-02-18 US disclosed
US-20080262208-A1 6-11 Bridged Oxime Erythromycin Derivatives WANG GUOQIANG 2008-10-23 US disclosed
US-20080146569-A1 Nicotinamide Derivatives PFIZER INC. 2008-06-19 US disclosed
WO-2007139856-A2 HETEROBICYCLIC METALLOPROTEASE INHIBITORS ALANTOS PHARMACEUTICALS, INC. (US) 2007-12-06 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 (6 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-11453790-B2 Photo-cleavable primer compositions and methods of use SP1, GPER1, ESR1 PTPN11 4409/4885CNR1 1675/4885CNR2 3083/4885
US-20200347248-A1 PHOTO-CLEAVABLE PRIMER COMPOSITIONS AND METHODS OF USE SP1, GPER1, ESR1 PTPN11 4409/4885CNR1 1675/4885CNR2 3083/4885
US-20230112086-A1 PHOTO-CLEAVABLE PRIMER COMPOSITIONS AND METHODS OF USE SP1, GPER1, ESR1 PTPN11 4409/4885CNR1 1675/4885CNR2 3083/4885
US-20100041618-A1 6-11 Bridged Oxime Erythromycin Derivatives CYP2D6, CYP2B6, CYP1B1 PTPN11 704/4885CNR1 2517/4885CNR2 2649/4885
US-20080146569-A1 Nicotinamide Derivatives NNT, NAMPT, NADK PTPN11 3568/4885CNR1 423/4885CNR2 373/4885
US-20080262208-A1 6-11 Bridged Oxime Erythromycin Derivatives CYP2D6, CYP2B6, CYP1B1 PTPN11 704/4885CNR1 2517/4885CNR2 2649/4885

“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.