SCHEMBL19320342

SCHEMBL19320342

CSc1nc(-c2cn(S(=O)(=O)c3ccc(C)cc3)c3ncncc23)ncc1F

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.40
PIM2 Q9P1W9 1/20 0.40
PTPN11 Q06124 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.34
GBA1 P04062 1/20 0.33
BRD4 O60885 4/20 0.33
EED O75530 1/20 0.32
HTR6 P50406 4/20 0.31
POLB P06746 2/20 0.31
ALDH3A1 P30838 1/20 0.31
HTT P42858 1/20 0.31
NOD1 Q9Y239 1/20 0.31
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL2126602 0.87 PTPN11 (0.42) PIM1PIM2PTPN11L3MBTL1BRD4
SCHEMBL19320346 0.85 PIM1 (0.40) PIM1PIM2PTPN11L3MBTL1GBA1
SCHEMBL18051842 0.85 PTPN11 (0.41) PIM1PIM2PTPN11L3MBTL1GBA1
SCHEMBL19325113 0.83 PIM1 (0.40) PIM1PIM2PTPN11L3MBTL1GBA1
SCHEMBL28542414 0.78 PIM1 (0.37) PIM1PIM2PTPN11L3MBTL1POLB
SCHEMBL19325201 0.75 PIM1 (0.41) PIM1PIM2PTPN11BRD4
SCHEMBL19325294 0.75 BRD4 (0.35) PIM1PIM2BRD4
SCHEMBL19320338 0.75 BRD4 (0.35) PIM1PIM2BRD4
SCHEMBL31246045 0.75 HTR6 (0.48) PTPN11L3MBTL1GBA1HTR6POLB
SCHEMBL13012809 0.74 PIM1 (0.36) PIM1PIM2L3MBTL1SMN1; SMN2

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-9932346-B2 Pyrrolopyrimidines for use in influenza virus infection JANSSEN SCIENCES IRELAND UC (IE) 2018-04-03 US disclosed
US-20170253600-A1 PYRROLOPYRIMIDINES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-09-07 US disclosed
US-20170253600-A1 PYRROLOPYRIMIDINES FOR USE IN INFLUENZA VIRUS INFECTION JANSSEN INFECTIOUS DISEASES BVBA (BE) 2017-09-07 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-20170253600-A1 PYRROLOPYRIMIDINES FOR USE IN INFLUENZA VIRUS INFECTION IMPDH1, IMPDH2, TYMP PIM1 480/4885PIM2 606/4885PTPN11 745/4885

“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.