SCHEMBL6802227

SCHEMBL6802227

COCC1Oc2ccc(C(C)=O)cc2OC1COC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
PTPN1 P18031 1/20 0.42
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
AKR1B1 P15121 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PKM P14618 1/20 0.36
CREBBP Q92793 1/20 0.36
HPGD P15428 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL6801600 0.88 PTPN1 (0.53) KDM4EPTPN1ALDH1A1TSHRAKR1B1
SCHEMBL6794906 0.79 MTNR1A (0.49) KDM4EALDH1A1MAPTTSHRMEN1
SCHEMBL5992714 0.79 KDM4E (0.48) KDM4EALDH1A1MAPTTSHRMEN1
SCHEMBL7171872 0.76 KDM4E (0.50) KDM4EPOLBAPEX1RECQLALDH1A1
SCHEMBL7150259 0.74 POLB (0.41) KDM4EPTPN1POLBAPEX1RECQL
SCHEMBL6796496 0.72 CA2 (0.41)
SCHEMBL10351287 0.71 PTPN1 (0.69) KDM4EPTPN1ALDH1A1MAPTTSHR
SCHEMBL10351288 0.71 PTPN1 (0.69) KDM4EPTPN1ALDH1A1MAPTTSHR
SCHEMBL10351289 0.71 PTPN1 (0.69) KDM4EPTPN1ALDH1A1MAPTTSHR
SCHEMBL11493699 0.69 KDM4E (0.50) KDM4EPOLBAPEX1RECQLALDH1A1

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-6835735-B2 Anticancer, tyrosine kinase inhibitors KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2004-12-28 US disclosed
US-20030045537-A1 4-(Phenylamino)-[1,4]dioxano[2,3-g]quinazoline derivatives and process for preparing the same KOREAN INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2003-03-06 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-20030045537-A1 4-(Phenylamino)-[1,4]dioxano[2,3-g]quinazoline derivatives and process for preparing the same EGFR, ERBB2, ERBB4 KDM4E 2246/4885PTPN1 596/4885POLB 3862/4885

“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.