SCHEMBL6285787

SCHEMBL6285787

CCCCCCCc1ccc(-n2c(C)ccc2-c2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.67
BCHE P06276 2/20 0.46
HRH3 Q9Y5N1 2/20 0.46
LTA4H P09960 1/20 0.45
EPHX2 P34913 1/20 0.45
MGLL Q99685 2/20 0.45
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PTGER1 P34995 1/20 0.43
HSD11B1 P28845 1/20 0.43

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
SCHEMBL6287247 1.00 PTPN1 (0.67) PTPN1BCHEHRH3LTA4HEPHX2
SCHEMBL6282831 1.00 PTPN1 (0.67) PTPN1BCHEHRH3LTA4HEPHX2
SCHEMBL6287192 1.00 PTPN1 (0.67) PTPN1BCHEHRH3LTA4HEPHX2
SCHEMBL6287327 0.99 PTPN1 (0.65) PTPN1BCHEHRH3LTA4HEPHX2
SCHEMBL6285933 0.91 PTPN1 (0.56) PTPN1BCHELTA4HEPHX2MGLL
SCHEMBL6279663 0.91 PTPN1 (0.56) PTPN1LTA4HNPC1RAB9AL3MBTL1
SCHEMBL6279323 0.91 PTPN1 (0.56) PTPN1LTA4HNPC1RAB9AL3MBTL1
SCHEMBL6285972 0.91 PTPN1 (0.56) PTPN1LTA4HNPC1RAB9AL3MBTL1
SCHEMBL6285976 0.91 PTPN1 (0.56) PTPN1BCHELTA4HEPHX2MGLL
SCHEMBL6282177 0.91 PTPN1 (0.56) PTPN1LTA4HNPC1RAB9AL3MBTL1

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 2/4885BCHE 4082/4885HRH3 1166/4885

“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.