SCHEMBL6284506

SCHEMBL6284506

CCCCCCCc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.66
EPHX2 P34913 1/20 0.66
BCHE P06276 3/20 0.63
MGLL Q99685 2/20 0.62
HRH3 Q9Y5N1 2/20 0.59
SIGMAR1 Q99720 1/20 0.56
FFAR1 O14842 1/20 0.55
FFAR4 Q5NUL3 1/20 0.55

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
SCHEMBL11051776 1.00 LTA4H (0.66) LTA4HEPHX2BCHEMGLLHRH3
SCHEMBL6283332 0.98 LTA4H (0.68) LTA4HEPHX2BCHEMGLLHRH3
SCHEMBL4059201 0.94 LTA4H (0.62) LTA4HEPHX2BCHEMGLLHRH3
SCHEMBL27312245 0.93 LTA4H (0.70) LTA4HEPHX2BCHEMGLLSIGMAR1
SCHEMBL12040562 0.91 LTA4H (0.77) LTA4HEPHX2BCHEMGLLFFAR1
SCHEMBL12630258 0.91 LTA4H (0.77) LTA4HEPHX2BCHEMGLLFFAR1
SCHEMBL3762431 0.89 SMPD1 (0.55) LTA4HEPHX2BCHEMGLLHRH3
SCHEMBL10339674 0.88 HRH3 (0.61) LTA4HEPHX2BCHEHRH3
SCHEMBL21125157 0.88 ALDH1A1 (0.63) LTA4HEPHX2HRH3
SCHEMBL855509 0.88 MAPT (0.65) LTA4HEPHX2BCHEMGLL

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 LTA4H 4503/4885EPHX2 2965/4885BCHE 4082/4885

“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.