SCHEMBL29614871

SCHEMBL29614871

CSc1ccccc1NC(=O)Nc1cc(-c2ccc3ccncc3c2)n(C)n1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IMPDH2 P12268 2/20 0.42
ALDH1A1 P00352 4/20 0.41
ALOX15 P16050 2/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 9/20 0.41
TP53 P04637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 8/20 0.40
MAPT P10636 8/20 0.40
AR P10275 1/20 0.39
POLB P06746 1/20 0.38
RAB9A P51151 4/20 0.38
GSK3B P49841 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.36

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
SCHEMBL19307104 1.00 IMPDH2 (0.42) IMPDH2ALDH1A1ALOX15HTTL3MBTL1
SCHEMBL29614745 0.87 RAB9A (0.47) IMPDH2ALDH1A1HTTL3MBTL1KMT2A
SCHEMBL19307218 0.87 RAB9A (0.47) IMPDH2ALDH1A1HTTL3MBTL1KMT2A
SCHEMBL19307111 0.86 KDM4E (0.53) IMPDH2ALDH1A1HTTKMT2AMEN1
SCHEMBL29614706 0.86 KDM4E (0.53) IMPDH2ALDH1A1HTTKMT2AMEN1
SCHEMBL19307170 0.85 IMPDH2 (0.54) IMPDH2KMT2AMEN1MAPTRAB9A
SCHEMBL29614729 0.85 IMPDH2 (0.54) IMPDH2KMT2AMEN1MAPTRAB9A
SCHEMBL29614804 0.83 F10 (0.40) IMPDH2GSK3B
SCHEMBL19307230 0.80 IMPDH2 (0.55) IMPDH2HTT
SCHEMBL29614770 0.80 IMPDH2 (0.55) IMPDH2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220160705-A1 METHODS FOR CONTROLLING PROSTAGLANDIN-MEDIATED BIOLOGICAL PROCESSES CORNELL UNIVERSITY 2022-05-26 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-20220160705-A1 METHODS FOR CONTROLLING PROSTAGLANDIN-MEDIATED BIOLOGICAL PROCESSES PTGES, PTGS1, PTGES2 IMPDH2 551/4885ALDH1A1 901/4885ALOX15 53/4885

“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.