SCHEMBL6325774

SCHEMBL6325774

CCCn1c(C)c(C(=O)c2ccc(C)c3ccccc23)c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 19/20 1.00
▸ CNR1 P21554 10/20 0.77
▸ MEN1 O00255 1/20 0.73
▸ NR1I2 O75469 1/20 0.73
▸ ALDH1A1 P00352 1/20 0.73
▸ CYP1A2 P05177 1/20 0.73
▸ MAPT P10636 1/20 0.73
▸ HPGD P15428 1/20 0.73
▸ TSHR P16473 1/20 0.73
▸ MAPK1 P28482 1/20 0.73
▸ CYP2C19 P33261 1/20 0.73
▸ KMT2A Q03164 1/20 0.73
▸ NR1H4 Q96RI1 1/20 0.73

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
SCHEMBL29387466 1.00 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL29388381 0.91 CNR2 (1.00) CNR2CNR1
SCHEMBL669446 0.89 CNR2 (0.81) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL29989065 0.88 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL6332169 0.88 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL29989734 0.86 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL6327412 0.86 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL29988425 0.85 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL497044 0.84 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1
SCHEMBL29988469 0.84 CNR2 (1.00) CNR2CNR1MEN1NR1I2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9034895-B2 Composition and methods for treating glioblastoma UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2015-05-19 — — US disclosed
US-9034895-B2 Composition and methods for treating glioblastoma UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2015-05-19 — — US disclosed
EP-2606032-B1 COMPOSITION AND METHODS FOR TREATING GLIOBLASTOMAS UNIV WASHINGTON CT COMMERCIALI (US) 2015-01-07 — — EP disclosed
US-20130197026-A1 COMPOSITION AND METHODS FOR TREATING GLIOBLASTOMA Unversity of Washington Through its Center for Commercialization (US) 2013-08-01 — — US disclosed
US-20130197026-A1 COMPOSITION AND METHODS FOR TREATING GLIOBLASTOMA Unversity of Washington Through its Center for Commercialization (US) 2013-08-01 — — US disclosed
WO-2013106460-A2 COMPOSITIONS AND METHODS FOR TREATING MALIGNANT ASTROCYTOMAS UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2013-07-18 — — WO disclosed
WO-2012024670-A2 COMPOSITION AND METHODS FOR TREATING GLIOBLASTOMA UNIVERSITY OF WASHINGTON THROUGH ITS CENTER FOR COMMERCIALIZATION (US) 2012-02-23 — — WO disclosed
US-20050009903-A1 CB2-selective cannabinoid analogues CLEMSON UNIVERSITY 2005-01-13 — — 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 (2 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-20050009903-A1 CB2-selective cannabinoid analogues CNR2, CNR1, GPR68 CNR2 1/4885CNR1 2/4885MEN1 1930/4885
US-20130197026-A1 COMPOSITION AND METHODS FOR TREATING GLIOBLASTOMA MGMT, NEFM, TP53 CNR2 1823/4885CNR1 2351/4885MEN1 1555/4885

“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.

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