SCHEMBL9923086

SCHEMBL9923086

Cc1cccn1NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.36
NPC1 O15118 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
GAA P10253 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
HTT P42858 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 1/20 0.35
MIF P14174 1/20 0.35
AKT1 P31749 2/20 0.35
MAPK10 P53779 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
RECQL P46063 1/20 0.34
KDM4A O75164 1/20 0.34

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
SCHEMBL1966568 0.80 NR1H2 (0.39) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL1854385 0.80 KDM4E (0.37) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL66516 0.78 CTSS (0.39) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL9920358 0.78 TSHR (0.38) RAB9ANPC1MEN1KMT2ACA12
SCHEMBL8836159 0.73 NOTUM (0.42) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL9980547 0.71 APLNR (0.36) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL59469 0.71 APLNR (0.36) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL4916320 0.70 HSP90AA1 (0.47) MEN1KMT2AMAPK1POLB
SCHEMBL7463790 0.69 NFKB1 (0.38) RAB9ANPC1MEN1KMT2AGAA
SCHEMBL16232232 0.69 LCK (0.35) GAACA12CA1CA7CA14

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-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2012-06-14 US disclosed
WO-2011014817-A1 PYRROLO [1, 2-B] PYRIDAZINE DERIVATIVES AS JANUS KINASE INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2011-02-03 WO 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-20120149691-A1 Pyrrolo [1,2-b] Pyridazine Derivatives as Janus Kinase Inhibitors JAK1, JAK2, JAK3 RAB9A 3327/4885NPC1 3905/4885MEN1 888/4885

“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.