SCHEMBL19626328

SCHEMBL19626328

Cc1nc2c(C)c(C)c(C)nc2s1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.36
DBF4 Q9UBU7 1/20 0.36
ADORA3 P0DMS8 4/20 0.34
ADORA2A P29274 4/20 0.34
ADORA2B P29275 4/20 0.34
ADORA1 P30542 4/20 0.34
PDE2A O00408 1/20 0.33
PDE4D Q08499 1/20 0.33
PDE3A Q14432 1/20 0.33
PDE10A Q9Y233 1/20 0.33

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
SCHEMBL23480329 0.80 ADORA3 (0.32) CDC7DBF4ADORA3ADORA2AADORA2B
SCHEMBL10093833 0.74 KDM4E (0.33) CDC7DBF4
SCHEMBL19626331 0.71 KDM4E (0.36)
SCHEMBL16604726 0.71 ADORA3 (0.34) ADORA3ADORA2AADORA2BADORA1
SCHEMBL14699733 0.69 HSD17B10 (0.41)
SCHEMBL17339844 0.69 ADORA3 (0.34) ADORA3ADORA2AADORA2BADORA1
SCHEMBL19267555 0.67 HSD17B10 (0.39)
SCHEMBL77254 0.67 HSD17B10 (0.39)
SCHEMBL19626332 0.67 KDM4E (0.36)
SCHEMBL178967 0.67 HSD17B10 (0.39) ADORA3ADORA2AADORA2BADORA1PDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180099921-A1 MIXTURE OF POLYMERIZABLE COMPOUND AND METHOD OF PRODUCING THE SAME ZEON CORPORATION (JP) 2018-04-12 US disclosed
US-20170335193-A1 POLYMERIZABLE COMPOUND, MIXTURE, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC PRODUCT, POLARIZING PLATE, FLAT PANEL DISPLAY DEVICE, ORGANIC ELECTROLUMINESCENCE DISPLAY DEVICE, AND ANTI-REFLECTION FILM ZEON CORPORATION (JP) 2017-11-23 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 (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-20180099921-A1 MIXTURE OF POLYMERIZABLE COMPOUND AND METHOD OF PRODUCING THE SAME DDT, CA4, DNMT3B CDC7 1233/4885DBF4 64/4885ADORA3 1142/4885
US-20170335193-A1 POLYMERIZABLE COMPOUND, MIXTURE, POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLYMER, OPTICAL FILM, OPTICALLY ANISOTROPIC PRODUCT, POLARIZING PLATE, FLAT PANEL DISPLAY DEVICE, ORGANIC ELECTROLUMINESCENCE DISPLAY DEVICE, AND ANTI-REFLECTION FILM NR2E3, NR3C2, NR2C2 CDC7 3162/4885DBF4 3392/4885ADORA3 627/4885

“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.