SCHEMBL6284364

SCHEMBL6284364

CCCCCC1CCC(COc2ccc(-n3c(C)ccc3-c3ccc(O)cc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
NR5A1 Q13285 1/20 0.38
MAPT P10636 3/20 0.36
LTA4H P09960 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
NR4A1 P22736 1/20 0.34
APEX1 P27695 1/20 0.34
ACACB O00763 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GRM2 Q14416 1/20 0.34
PTGER1 P34995 1/20 0.34
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL6284334 0.97 PTPN1 (0.40) PTPN1NR5A1MAPTLTA4HKDM4E
SCHEMBL6279867 0.93 MAPT (0.38) PTPN1MAPTKDM4EALDH1A1NR4A1
SCHEMBL6279655 0.88 PTPN1 (0.47) PTPN1MAPTKDM4EALDH1A1MEN1
SCHEMBL6282212 0.85 PTPN1 (0.45) PTPN1MAPTKDM4EALDH1A1MEN1
SCHEMBL6284380 0.83 ADORA3 (0.36) PTPN1NR5A1LTA4HKDM4EALDH1A1
SCHEMBL9815825 0.82 NR5A1 (0.54) NR5A1LTA4HACACB
SCHEMBL6282844 0.81 NR5A1 (0.60) PTPN1NR5A1MAPTLTA4HKDM4E
SCHEMBL6283222 0.81 NR5A1 (0.60) PTPN1NR5A1MAPTLTA4HKDM4E
SCHEMBL6279523 0.81 NR5A1 (0.60) PTPN1NR5A1MAPTLTA4HKDM4E
SCHEMBL6284481 0.81 PTPN1 (0.70) PTPN1

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 2/4885NR5A1 160/4885MAPT 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.