SCHEMBL2331318

SCHEMBL2331318

O=C(O)N1CCC(Nc2nc(Cl)ncc2-c2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.44
IRAK1 P51617 2/20 0.43
IRAK4 Q9NWZ3 1/20 0.43
JAK3 P52333 9/20 0.41
JAK2 O60674 7/20 0.40
TYRO3 Q06418 3/20 0.39
MERTK Q12866 3/20 0.39
SPR P35270 1/20 0.39
BTK Q06187 3/20 0.39
EGFR P00533 2/20 0.39
USP30 Q70CQ3 1/20 0.39
ITK Q08881 1/20 0.39

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
SCHEMBL2330729 0.86 USP30 (0.58) BTKEGFRUSP30
SCHEMBL2330725 0.86 USP30 (0.58) BTKEGFRUSP30
SCHEMBL2332984 0.83 CHEK2 (0.49) IRAK1IRAK4JAK3JAK2
SCHEMBL3434611 0.81 KMT2A (0.56) BTKEGFRITK
SCHEMBL3190443 0.81 KMT2A (0.39) JAK3JAK2BTK
SCHEMBL2334905 0.81 ABL1 (0.41) JAK3JAK2SPRBTK
SCHEMBL28333053 0.81 KMT2A (0.56) BTKEGFRITK
SCHEMBL2331315 0.78 CHEK2 (0.47) MERTKSPRBTK
SCHEMBL19665640 0.78 HSD11B1 (0.47) JAK3JAK2
SCHEMBL22439077 0.76 KMT2A (0.45) AXLJAK3JAK2BTKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324226-B2 Therapeutic oxy-phenyl-aryl compounds and their use CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-12-04 US disclosed
EP-2227460-B1 THERAPEUTIC OXY-PHENYL-ARYL COMPOUNDS AND THEIR USE CANCER REC TECH LTD (GB) 2012-06-20 EP disclosed
US-20110201592-A1 Therapeutic Oxy-Phenyl-Aryl Compounds and Their Use CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2011-08-18 US disclosed
EP-2227460-A1 THERAPEUTIC OXY-PHENYL-ARYL COMPOUNDS AND THEIR USE Cancer Research Technology Limited (GB) 2010-09-15 EP disclosed
WO-2009053694-A1 THERAPEUTIC OXY-PHENYL-ARYL COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-04-30 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-20110201592-A1 Therapeutic Oxy-Phenyl-Aryl Compounds and Their Use CHEK2, CHEK1, PLK1 AXL 750/4885IRAK1 1122/4885IRAK4 1294/4885

“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.