SCHEMBL2707210

SCHEMBL2707210

CC(C)c1ccc2c(c1)Nc1ccc(C(C)C)cc1C(=O)N2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 2/20 0.51
LRRK2 Q5S007 2/20 0.51
ROS1 P08922 1/20 0.51
CDK5 Q00535 1/20 0.51
HPGD P15428 1/20 0.49
GFER P55789 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CSNK1G1 Q9HCP0 1/20 0.49
CHEK1 O14757 1/20 0.45
PDGFRA P16234 1/20 0.44
FER P16591 1/20 0.44
LTK P29376 1/20 0.44
CDK8 P49336 1/20 0.44
DYRK1B Q9Y463 1/20 0.44
EGFR P00533 1/20 0.43
ERBB2 P04626 1/20 0.43
IGF1R P08069 1/20 0.43
PDGFRB P09619 1/20 0.43
GLB1 P16278 1/20 0.43
CTRC Q99895 1/20 0.43

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
SCHEMBL18418044 1.00 ACVR1 (0.51) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL15996248 0.91 ACVR1 (0.67) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL2756784 0.91 CSNK1G1 (0.63) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL2705692 0.90 CSNK1G1 (0.49) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL17656324 0.87 SMN1; SMN2 (0.46) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL2756590 0.83 CSNK1G1 (0.61) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL9980151 0.83 CSNK1G1 (0.61) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL4444879 0.82 TGM2 (0.55) HPGDGFERHSD17B10EGFRERBB2
SCHEMBL12120564 0.79 HPGD (0.49) ACVR1LRRK2ROS1CDK5HPGD
SCHEMBL13864422 0.79 HPGD (0.45) ACVR1LRRK2ROS1CDK5HPGD

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9981955-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2018-05-29 US disclosed
US-9981955-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2018-05-29 US disclosed
US-20170029408-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-02-02 US disclosed
US-20170029408-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-02-02 US disclosed
US-9511056-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2016-12-06 US disclosed
US-9511056-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2016-12-06 US disclosed
EP-2857394-A1 Antiviral compounds Gilead Pharmasset LLC (US) 2015-04-08 EP disclosed
US-8841278-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2014-09-23 US disclosed
US-20140249074-A1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC (US) 2014-09-04 US disclosed
US-20140249074-A1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC (US) 2014-09-04 US disclosed
US-8575118-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2013-11-05 US disclosed
US-20130137877-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-05-30 US disclosed
US-20120264711-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-10-18 US disclosed
US-20120264711-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-10-18 US disclosed
US-8273341-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-09-25 US disclosed
US-20120157404-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2012-06-21 US disclosed
US-8088368-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-01-03 US disclosed
US-8088368-B2 Antiviral compounds GILEAD SCIENCES, INC. (US) 2012-01-03 US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 US disclosed
US-20100310512-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2010-12-09 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 (6 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-20170029408-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ACVR1 4183/4885LRRK2 2533/4885ROS1 4338/4885
US-20130137877-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ACVR1 4183/4885LRRK2 2533/4885ROS1 4338/4885
US-20120264711-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ACVR1 4183/4885LRRK2 2533/4885ROS1 4338/4885
US-20120157404-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ACVR1 4183/4885LRRK2 2533/4885ROS1 4338/4885
US-20100310512-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ACVR1 4183/4885LRRK2 2533/4885ROS1 4338/4885
US-20140249074-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, ZC3HAV1 ACVR1 4183/4885LRRK2 2533/4885ROS1 4338/4885

“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.