SCHEMBL204292

SCHEMBL204292

c1cnc2c(c1)ncc1nc3n(c12)CCN3

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 2/20 0.47
POLB P06746 1/20 0.39
TGFBR1 P36897 4/20 0.38
MAPK10 P53779 1/20 0.38
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
SLC6A4 P31645 1/20 0.35
PARP1 P09874 7/20 0.35
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL2743292 0.81 KDM4E (0.58) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL202005 0.78 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL1104756 0.75 ALDH1A1 (0.54) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL31249024 0.68 KDM4E (0.61) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL202430 0.68 NOS2 (0.44) KDM4EALDH1A1POLBHTR2AHTR2C
SCHEMBL1104767 0.67 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL203571 0.67 KDM5B (0.39) KDM4E
SCHEMBL205143 0.66 KDM4E (0.40) KDM4EALDH1A1POLB
SCHEMBL1232959 0.66 JAK2 (0.36) ALDH1A1
SCHEMBL14644488 0.65 JAK1 (0.37) KDM4EALDH1A1HPGDHSD17B10HTR2A

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-8088788-B2 Substituted fused[1,2] imidazo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-01-03 US disclosed
US-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS PFIZER INC. 2009-09-03 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-20090221551-A1 SUBSTITUTED FUSED[1,2] IMIDAZO[4,5C] RING COMPOUNDS AND METHODS IL2, IFNG, IL4 KDM4E 2419/4885ALDH1A1 979/4885HPGD 235/4885

“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.