SCHEMBL1789998

SCHEMBL1789998

Fc1ccccc1C1(c2ccc(N3CCCC3)cc2)C=Cc2c(cc(-c3ccc(-c4ccccc4)s3)c3ccccc23)O1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.37
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL4226841 0.85 PRKDC (0.33) PRKDCKDM4EALDH1A1
SCHEMBL12610512 0.78 HSD17B1 (0.34) PRKDC
SCHEMBL13219241 0.78 HRH3 (0.33)
SCHEMBL2599682 0.77 SMN1; SMN2 (0.37) PRKDCKDM4EALDH1A1GAA
SCHEMBL13219242 0.76 PDK2 (0.33)
SCHEMBL13699530 0.74 ALDH1A1 (0.36) KDM4EALDH1A1GAA
SCHEMBL13240239 0.73 KIF11 (0.36) PRKDCKDM4EALDH1A1GAA
SCHEMBL13488507 0.73 MAPT (0.35) KDM4EALDH1A1GAA
SCHEMBL3028310 0.72 CNR1 (0.34) KDM4EALDH1A1
SCHEMBL2599693 0.72 SMN1; SMN2 (0.37) KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8703978-B2 Photochromic dichroic naphtho-pyrans and optical articles containing them ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2014-04-22 US claimed
EP-2098520-B1 Photochromic dichroic naphtho-pyrans and optical articles containing them ESSILOR INT (FR) 2013-07-03 EP claimed
US-20110122475-A1 PHOTOCHROMIC DICHROIC NAPHTHO-PYRANS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2011-05-26 US claimed
EP-2098520-A1 Photochromic dichroic naphtho-pyrans and optical articles containing them Essilor International (Compagnie Générale D'Optique) (FR) 2009-09-09 EP claimed
US-8703978-B2 Photochromic dichroic naphtho-pyrans and optical articles containing them ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2014-04-22 US disclosed
EP-2098520-B1 Photochromic dichroic naphtho-pyrans and optical articles containing them ESSILOR INT (FR) 2013-07-03 EP disclosed
EP-2098520-B1 Photochromic dichroic naphtho-pyrans and optical articles containing them ESSILOR INT (FR) 2013-07-03 EP disclosed
US-20110122475-A1 PHOTOCHROMIC DICHROIC NAPHTHO-PYRANS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2011-05-26 US disclosed
US-20110122475-A1 PHOTOCHROMIC DICHROIC NAPHTHO-PYRANS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2011-05-26 US disclosed
US-20110122475-A1 PHOTOCHROMIC DICHROIC NAPHTHO-PYRANS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2011-05-26 US disclosed
WO-2009109546-A1 PHOTOCHROMIC DICHROIC NAPHTHO-PYRANS AND OPTICAL ARTICLES CONTAINING THEM ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2009-09-11 WO disclosed
EP-2098520-A1 Photochromic dichroic naphtho-pyrans and optical articles containing them Essilor International (Compagnie Générale D'Optique) (FR) 2009-09-09 EP disclosed
EP-2098520-A1 Photochromic dichroic naphtho-pyrans and optical articles containing them Essilor International (Compagnie Générale D'Optique) (FR) 2009-09-09 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-20110122475-A1 PHOTOCHROMIC DICHROIC NAPHTHO-PYRANS AND OPTICAL ARTICLES CONTAINING THEM NR2E3, NR2C2, NR5A2 PRKDC 4610/4885KDM4E 3858/4885ALDH1A1 1244/4885

“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.