SCHEMBL3374890

SCHEMBL3374890

Cc1ccc(C(=O)N2CC(n3cc(-c4ncnc5[nH]ccc45)cn3)C2)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 20/20 0.49
JAK1 P23458 12/20 0.49
HDAC6 Q9UBN7 2/20 0.45
HDAC3 O15379 1/20 0.45
TYK2 P29597 1/20 0.45
JAK3 P52333 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC9 Q9UKV0 1/20 0.45
HDAC5 Q9UQL6 1/20 0.45
NCOR2 Q9Y618 1/20 0.45

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
SCHEMBL3375100 0.90 JAK2 (0.57) JAK2JAK1HDAC6
SCHEMBL3376937 0.89 JAK2 (0.50) JAK2JAK1
SCHEMBL3374832 0.85 JAK2 (0.53) JAK2JAK1HDAC6
SCHEMBL3434304 0.84 JAK2 (0.49) JAK2JAK1HDAC6HDAC3TYK2
SCHEMBL3374032 0.83 JAK2 (0.53) JAK2JAK1HDAC6HDAC3TYK2
SCHEMBL3373671 0.83 JAK2 (0.45) JAK2JAK1HDAC6HDAC3TYK2
SCHEMBL3374887 0.82 JAK2 (0.47) JAK2JAK1HDAC6HDAC3TYK2
SCHEMBL17387452 0.82 JAK2 (0.68) JAK2JAK1
SCHEMBL3373926 0.81 JAK2 (0.44) JAK2JAK1HDAC6HDAC3TYK2
SCHEMBL14563475 0.81 JAK2 (0.67) JAK2JAK1

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-20130310340-A1 METHOD OF TREATING MUSCULAR DEGRADATION RIGEL PHARMACEUTICALS, INC. (US) 2013-11-21 US disclosed
WO-2013173506-A2 METHOD OF TREATING MUSCULAR DEGRADATION RIGEL PHARMACEUTICALS, INC. (US) 2013-11-21 WO disclosed
WO-2010039939-A1 JANUS KINASE INHIBITORS FOR TREATMENT OF DRY EYE AND OTHER EYE RELATED DISEASES INCYTE CORPORATION (US) 2010-04-08 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-20130310340-A1 METHOD OF TREATING MUSCULAR DEGRADATION PYGM, CKMT1A; CKMT1B, SMN1; SMN2 JAK2 4729/4885JAK1 4796/4885HDAC6 278/4885

“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.