SCHEMBL1668635

SCHEMBL1668635

CC1(C)[C@H]2CC[C@]1(C)[C@@H](O)[C@H]2O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.36
DPP4 P27487 1/20 0.35
SHBG P04278 2/20 0.32
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP3A4 P08684 1/20 0.30
KMT2A Q03164 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
SCHEMBL29761172 1.00 CNR2 (0.36) CNR2DPP4SHBGMEN1ALDH1A1
SCHEMBL5407267 1.00 CNR2 (0.36) CNR2DPP4SHBGMEN1ALDH1A1
SCHEMBL1668637 1.00 CNR2 (0.36) CNR2DPP4SHBGMEN1ALDH1A1
SCHEMBL30148076 1.00 CNR2 (0.36) CNR2DPP4SHBGMEN1ALDH1A1
SCHEMBL13320075 0.79 CNR2 (0.35) CNR2DPP4SHBG
SCHEMBL24052391 0.77 CNR2 (0.35) CNR2DPP4SHBGMEN1ALDH1A1
SCHEMBL9360142 0.77 CNR2 (0.35) CNR2DPP4SHBG
SCHEMBL253323 0.77 CNR2 (0.35) CNR2DPP4SHBG
SCHEMBL7673902 0.77 CNR2 (0.35) CNR2DPP4SHBG
SCHEMBL6507028 0.77 CNR2 (0.35) CNR2DPP4SHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 EP claimed
WO-2011043817-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2011-04-14 WO claimed
US-9771345-B2 Coferons and methods of making and using them CORNELL UNIVERSITY (US) 2017-09-26 US disclosed
US-20140357806-A1 THERMAL-RESPONSIVE POLYMER NETWORKS, COMPOSITIONS, AND METHODS AND APPLICATIONS RELATED THERETO UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL (US) 2014-12-04 US disclosed
US-20140161729-A1 COFLUORONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2014-06-12 US disclosed
US-8597630-B2 Thermal-responsive polymer networks, compositions, and methods and applications related thereto UNIVERSITY OF MASSACHUSETTS (US) 2013-12-03 US disclosed
US-20120295874-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2012-11-22 US disclosed
WO-2012154213-A1 COFLUORONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2012-11-15 WO disclosed
EP-2485678-A1 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2012-08-15 EP disclosed
WO-2011120002-A1 THERMAL-RESPONSIVE POLYMER NETWORKS, COMPOSITIONS, AND METHODS AND APPLICATIONS RELATED THERETO UNIVERSITY OF MASSACHUSETTS (US) 2011-09-29 WO disclosed
WO-2011043817-A1 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2011-04-14 WO disclosed
US-20100280561-A1 Thermal-Responsive Polymer Networks, Compositions, And Methods And Applications Related Thereto UNIVERSITY OF MASSACHUSETTS MEDICAL SCHOOL 2010-11-04 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-20120295874-A1 COFERONS AND METHODS OF MAKING AND USING THEM MYOF, FTH1, HCCS CNR2 2399/4885DPP4 3310/4885SHBG 300/4885
US-20140161729-A1 COFLUORONS AND METHODS OF MAKING AND USING THEM TNFSF11, CD14, TNFRSF1A CNR2 1466/4885DPP4 3760/4885SHBG 1432/4885

“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.