SCHEMBL1815196

SCHEMBL1815196

COc1ccc(C2(c3ccc(OCCO)cc3)C=Cc3c4c(c5cc(OC)c(OC)cc5c3O2)-c2ccc(C#N)cc2C4(C)C)cc1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 19/20 0.37
ICMT O60725 1/20 0.31

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
SCHEMBL8509414 0.95 ALK (0.34) ALK
SCHEMBL1009119 0.93 ALK (0.35) ALK
SCHEMBL1009178 0.89 ALK (0.33) ALK
SCHEMBL26231110 0.88 PDK2 (0.31) ALK
SCHEMBL25606363 0.88 ALDH1A1 (0.35)
SCHEMBL1815536 0.88 PTGDR2 (0.34) ALK
SCHEMBL15318062 0.88 ALK (0.36) ALK
SCHEMBL30750473 0.88 PTGDR2 (0.34) ALK
SCHEMBL15315511 0.87 ALK (0.32) ALK
SCHEMBL26661540 0.87 ALK (0.32) ALK

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2494408-B9 PHOTOCHROMIC MATERIALS TRANSITIONS OPTICAL INC (US) 2015-09-02 EP disclosed
EP-2494408-B1 PHOTOCHROMIC MATERIALS TRANSITIONS OPTICAL INC (US) 2015-04-15 EP disclosed
US-8518305-B2 Photochromic materials TRANSITIONS OPTICAL, INC. (US) 2013-08-27 US disclosed
US-20110108781-A1 PHOTOCHROMIC MATERIALS TRANSITIONS OPTICAL, INC. (US) 2011-05-12 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-20110108781-A1 PHOTOCHROMIC MATERIALS INCENP, SMCHD1, NEDD8 ALK 1877/4885ICMT 93/4885

“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.