SCHEMBL4295027

SCHEMBL4295027

CC1CN(Cc2c(F)cc(-n3ccc4cnc(Nc5ccc(N6CCNCC6)nc5)nc43)cc2F)CC(C)O1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 13/20 0.47
BRD4 O60885 13/20 0.47
STAT6 P42226 1/20 0.45
JAK1 P23458 5/20 0.45
BRD2 P25440 5/20 0.45
JAK3 P52333 5/20 0.45
BRD3 Q15059 5/20 0.45
BRDT Q58F21 5/20 0.45
CDK4 P11802 4/20 0.43
CDK6 Q00534 2/20 0.43
PIK3CD O00329 1/20 0.43
CSF1R P07333 1/20 0.43
CCND1 P24385 2/20 0.42
CDK1 P06493 1/20 0.42
CCNB1 P14635 1/20 0.42
FLT3 P36888 1/20 0.42
RPS6KA3 P51812 2/20 0.41
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40

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
SCHEMBL4295028 1.00 JAK2 (0.47) JAK2BRD4STAT6JAK1BRD2
SCHEMBL4287678 0.92 RPS6KA3 (0.51) JAK2BRD4STAT6JAK1BRD2
SCHEMBL4287680 0.92 RPS6KA3 (0.51) JAK2BRD4STAT6JAK1BRD2
SCHEMBL4291686 0.88 RPS6KA3 (0.51) JAK2BRD4STAT6JAK1BRD2
SCHEMBL22511944 0.87 JAK2 (0.46) JAK2BRD4STAT6JAK1BRD2
SCHEMBL4288572 0.85 JAK2 (0.48) JAK2BRD4STAT6JAK1BRD2
SCHEMBL4288575 0.85 JAK2 (0.47) JAK2BRD4STAT6JAK1BRD2
SCHEMBL1655083 0.82 RPS6KA3 (0.49) JAK2BRD4STAT6JAK1BRD2
SCHEMBL1655086 0.82 RPS6KA3 (0.49) JAK2BRD4STAT6JAK1BRD2
SCHEMBL1657566 0.81 JAK2 (0.46) JAK2BRD4STAT6JAK1BRD2

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-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 US claimed
US-8420657-B2 Pyrrolo[2,3-D]pyrimidines and use thereof as tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-04-16 US disclosed
US-20090203688-A1 HETEROCYCLIC COMPOUNDS NOVARTIS AG 2009-08-13 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-20090203688-A1 HETEROCYCLIC COMPOUNDS ABL1, JAK2, JAK1 JAK2 2/4885BRD4 964/4885STAT6 601/4885

“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.