SCHEMBL164380

SCHEMBL164380

NC(=O)c1ccccc1NC(=O)C(F)(F)c1ccc(F)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 6/20 0.50
JAK1 P23458 6/20 0.50
TYK2 P29597 6/20 0.50
JAK3 P52333 2/20 0.50
STAT3 P40763 1/20 0.50
PDE4D Q08499 1/20 0.45
MAPK10 P53779 3/20 0.44
MAPK8 P45983 2/20 0.44
GLA P06280 1/20 0.43
KDM4E B2RXH2 4/20 0.42
ALDH1A1 P00352 3/20 0.42
AGTR1 P30556 1/20 0.42
MAPK9 P45984 1/20 0.42
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
IRAK4 Q9NWZ3 2/20 0.40
HPGD P15428 1/20 0.40
CDC7 O00311 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
SCHEMBL176261 0.85 JAK2 (0.46) JAK2JAK1TYK2JAK3STAT3
SCHEMBL161330 0.82 JAK2 (0.39) JAK2JAK1TYK2JAK3STAT3
SCHEMBL159515 0.80 AGTR1 (0.50) MAPK10MAPK8KDM4EALDH1A1AGTR1
SCHEMBL8645992 0.75 KDM4E (0.55) JAK2GLAKDM4EALDH1A1NPC1
SCHEMBL30087636 0.73 KCNN4 (0.41) JAK2JAK1TYK2JAK3STAT3
SCHEMBL158432 0.72 JAK2 (0.49) JAK2JAK1TYK2JAK3STAT3
SCHEMBL30932784 0.69 KDM4E (0.42) GLAKDM4EALDH1A1IRAK4CDC7
SCHEMBL3078843 0.69 KDM4E (0.72) GLAKDM4EALDH1A1NPC1RAB9A
SCHEMBL30628308 0.68 TRPV4 (0.35) KDM4E
SCHEMBL160471 0.68 TRPV4 (0.35) KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633207-B2 Quinazoline compounds and methods of use thereof AMBIT BIOSCIENCES CORPORATION (US) 2014-01-21 US disclosed
EP-2611789-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF Ambit Biosciences Corporation (US) 2013-07-10 EP disclosed
WO-2012030948-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION (US) 2012-03-08 WO disclosed
US-20120053174-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF AMBIT BIOSCIENCES CORPORATION 2012-03-01 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-20120053174-A1 QUINAZOLINE COMPOUNDS AND METHODS OF USE THEREOF JAK3, JAK2, TYK2 JAK2 2/4885JAK1 4/4885TYK2 3/4885

“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.