SCHEMBL14852933

SCHEMBL14852933

Cc1cnc(-c2cnc3ccc(F)cn23)nc1Cl

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 11/20 0.46
JAK3 P52333 11/20 0.46
JAK1 P23458 10/20 0.46
ADORA2A P29274 6/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
PIK3CA P42336 1/20 0.36
MTOR P42345 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
SCHEMBL1996420 0.86 JAK2 (0.47) JAK2JAK3JAK1ADORA2APIK3CA
SCHEMBL16824620 0.86 JAK2 (0.43) JAK2JAK3JAK1ADORA2ACYP11B1
SCHEMBL12644096 0.84 JAK2 (0.43) JAK2JAK3JAK1ADORA2APIK3CA
SCHEMBL1994455 0.84 JAK2 (0.46) JAK2JAK3JAK1ADORA2ACYP11B1
SCHEMBL2032583 0.83 JAK2 (0.44) JAK2JAK3JAK1CYP11B1CYP11B2
SCHEMBL2035111 0.83 JAK2 (0.42) JAK2JAK3JAK1ADORA2APIK3CA
SCHEMBL1995017 0.82 JAK2 (0.44) JAK2JAK3JAK1CYP11B1CYP11B2
SCHEMBL15198118 0.81 JAK2 (0.45) JAK2JAK3JAK1ADORA2AALDH1A1
SCHEMBL2033332 0.81 JAK2 (0.41) JAK2JAK3JAK1ADORA2APIK3CA
SCHEMBL12067354 0.81 JAK2 (0.44) JAK2JAK3JAK1ADORA2APIK3CA

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-20130089512-A1 HETEROARYL IMIDAZOLONE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2013-04-11 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-20130089512-A1 HETEROARYL IMIDAZOLONE DERIVATIVES AS JAK INHIBITORS JAK2, JAK1, JAK3 JAK2 1/4885JAK3 3/4885JAK1 2/4885

“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.