SCHEMBL3922919

SCHEMBL3922919

CC(=O)NC1CCN(c2nc(Nc3cc(C(=O)NC4CC4)[nH]n3)n3cccc3n2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.43
USP30 Q70CQ3 3/20 0.39
KDM4E B2RXH2 2/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPK8 P45983 1/20 0.38
RET P07949 1/20 0.36
P2RX3 P56373 1/20 0.36
CCNE1 P24864 4/20 0.36
CDK2 P24941 4/20 0.36
KDM5B Q9UGL1 1/20 0.35
SUV39H2 Q9H5I1 1/20 0.35
SYK P43405 1/20 0.35
SMPD3 Q9NY59 2/20 0.35
MLLT3 P42568 1/20 0.35
MLLT1 Q03111 1/20 0.35

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
SCHEMBL3921427 0.85 JAK2 (0.43) JAK2USP30KDM4EPOLBMAPT
SCHEMBL13841080 0.80 JAK2 (0.66) JAK2CCNE1CDK2
SCHEMBL3926096 0.80 MAPK8 (0.45) JAK2USP30KDM4EPOLBMAPT
SCHEMBL3922888 0.79 JAK2 (0.43) JAK2KDM4EPOLBMAPTTDP1
SCHEMBL3924285 0.79 JAK2 (0.44) JAK2KDM4EPOLBMAPTTDP1
SCHEMBL3932781 0.78 NUDT1 (0.46) JAK2USP30KDM4EPOLBMAPT
SCHEMBL3923459 0.78 JAK2 (0.44) JAK2KDM4EPOLBMAPTTDP1
SCHEMBL3926065 0.78 PIK3CB (0.36) KDM4EPOLBMAPTTDP1ALDH1A1
SCHEMBL3926142 0.77 NUDT1 (0.41) JAK2KDM4EPOLBMAPTTDP1
SCHEMBL3921271 0.77 NUDT1 (0.55) JAK2USP30KDM4EPOLBMAPT

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
EP-2051980-B1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2014-02-26 EP disclosed
US-7531539-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2009-05-12 US disclosed
US-20080045496-A1 PYRROLOTRIAZINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 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-20080045496-A1 PYRROLOTRIAZINE KINASE INHIBITORS JAK2, NTRK2, NTRK3 JAK2 1/4885USP30 2950/4885KDM4E 1939/4885

“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.