SCHEMBL2335808

SCHEMBL2335808

COCCOc1ccc2c(O)nc(O)nc2c1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 3/20 0.44
KDR P35968 2/20 0.42
CHEK1 O14757 2/20 0.41
CHEK2 O96017 2/20 0.41
MAOA P21397 1/20 0.41
DYRK1A Q13627 1/20 0.41
ILK Q13418 2/20 0.40
EGFR P00533 1/20 0.40
FGFR1 P11362 1/20 0.40
FLT1 P17948 1/20 0.40
MIF P14174 3/20 0.39
SLC22A12 Q96S37 1/20 0.39
APP P05067 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NCF1 P14598 3/20 0.37

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
SCHEMBL2174621 0.81 MPO (0.47) EGFRAPPALDH1A1HSD17B10
SCHEMBL23264581 0.81 KDR (0.54) GRM4KDRMAOADYRK1AILK
SCHEMBL9616706 0.78 MIF (0.45) GRM4KDRCHEK1CHEK2MIF
SCHEMBL5256515 0.75 MAOA (0.48) GRM4KDRMAOADYRK1AMIF
SCHEMBL27248610 0.75 ALDH1A1 (0.46) FGFR1ALDH1A1CASP1CASP7HSD17B10
SCHEMBL20589705 0.74 KMT2A (0.42) MAOAFGFR1ALDH1A1HSD17B10
SCHEMBL29880457 0.74 KMT2A (0.42) MAOAFGFR1ALDH1A1HSD17B10
SCHEMBL16537752 0.72 MIF (0.43) CHEK2MIFSLC22A12APPALDH1A1
SCHEMBL1012140 0.72 FBP1 (0.53) GRM4KDRILKEGFRFGFR1
SCHEMBL21707866 0.71 HSD17B10 (0.54) ALDH1A1CASP1CASP7HSD17B10

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 10 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
US-8324226-B2 Therapeutic oxy-phenyl-aryl compounds and their use CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-12-04 US disclosed
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
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
US-20110201592-A1 Therapeutic Oxy-Phenyl-Aryl Compounds and Their Use CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2011-08-18 US 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 GRM4 4708/4885KDR 1670/4885CHEK1 2/4885

“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.