SCHEMBL6284334

SCHEMBL6284334

CCCCC1CCC(COc2ccc(-n3c(C)ccc3-c3ccc(O)cc3)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.40
KDM4E B2RXH2 3/20 0.37
MAPT P10636 3/20 0.37
ALDH1A1 P00352 3/20 0.37
LTA4H P09960 2/20 0.36
NR5A1 Q13285 1/20 0.36
NR4A1 P22736 1/20 0.35
APEX1 P27695 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ACACB O00763 2/20 0.34
PTGER1 P34995 1/20 0.34
PKM P14618 2/20 0.34
HTT P42858 1/20 0.34
HPGD P15428 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL6284364 0.97 PTPN1 (0.41) PTPN1KDM4EMAPTALDH1A1LTA4H
SCHEMBL6279867 0.94 MAPT (0.38) PTPN1KDM4EMAPTALDH1A1NR4A1
SCHEMBL6282212 0.88 PTPN1 (0.45) PTPN1KDM4EMAPTALDH1A1MEN1
SCHEMBL6279655 0.85 PTPN1 (0.47) PTPN1KDM4EMAPTALDH1A1MEN1
SCHEMBL6286004 0.82 PTPN1 (0.42) PTPN1KDM4EMAPTALDH1A1MEN1
SCHEMBL6284044 0.81 PTPN1 (0.68) PTPN1
SCHEMBL6284380 0.80 ADORA3 (0.36) PTPN1KDM4EALDH1A1LTA4HNR5A1
SCHEMBL6282844 0.80 NR5A1 (0.60) PTPN1KDM4EMAPTALDH1A1LTA4H
SCHEMBL6279523 0.80 NR5A1 (0.60) PTPN1KDM4EMAPTALDH1A1LTA4H
SCHEMBL6283222 0.80 NR5A1 (0.60) PTPN1KDM4EMAPTALDH1A1LTA4H

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-6911468-B2 Tyrosine phosphatase inhibitors TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-06-28 US disclosed
US-20030144338-A1 Tyrosine phosphatase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-07-31 US disclosed
EP-1284260-A1 TYROSINE PHOSPHATASE INHIBITORS Takeda Chemical Industries, Ltd. (JP) 2003-02-19 EP 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-20030144338-A1 Tyrosine phosphatase inhibitors PTPRC, PTPN1, PTPRM PTPN1 2/4885KDM4E 171/4885MAPT 4800/4885

“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.