SCHEMBL1698073

SCHEMBL1698073

CC(=O)C1(C)CC2C=CC1C2

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.41
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL9984759 1.00 P2RX7 (0.41) P2RX7CYP2D6CYP2C19
SCHEMBL9984755 1.00 P2RX7 (0.41) P2RX7CYP2D6CYP2C19
SCHEMBL19381628 0.86 P2RX7 (0.42) P2RX7CYP2D6CYP2C19
SCHEMBL3901853 0.84 P2RX7 (0.41) P2RX7CYP2D6CYP2C19
SCHEMBL76783 0.84 P2RX7 (0.41) P2RX7CYP2D6CYP2C19
SCHEMBL12191694 0.84 P2RX7 (0.41) P2RX7CYP2D6CYP2C19
SCHEMBL5423530 0.84 P2RX7 (0.41) P2RX7CYP2D6CYP2C19
SCHEMBL32688678 0.84 P2RX7 (0.41) P2RX7CYP2D6CYP2C19
Hydrochloric Acid SCHEMBL3901856 0.82 P2RX7 (0.40) P2RX7CYP2D6CYP2C19
SCHEMBL7112807 0.82 P2RX7 (0.40) P2RX7CYP2D6CYP2C19

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
EP-2585569-A1 PERFUME SYSTEMS The Procter and Gamble Company (US) 2013-05-01 EP claimed
WO-2011163337-A1 PERFUME SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 2011-12-29 WO claimed
US-20110308555-A1 PERFUME SYSTEMS PROCTER & GAMBLE COMPANY, THE 2011-12-22 US claimed
US-20200115400-A1 METHOD FOR PRODUCING SILICON COMPOUND, AND SILICON COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-04-16 US disclosed
EP-2802326-B1 HEPATITIS C VIRUS INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-04-18 EP disclosed
US-9770439-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-26 US disclosed
EP-3085759-A2 PERFUME SYSTEMS The Procter and Gamble Company (US) 2016-10-26 EP disclosed
US-20160199355-A1 HEPATITIS C VIRUS INHIBITORS BRISTOL MAYERS SQUIBB COMPANY (US) 2016-07-14 US disclosed
US-20160158200-A1 Combinations of Hepatitis C Virus Inhibitors BRISTOL MYERS SQUIBB CO (US) 2016-06-09 US disclosed
US-9326973-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2016-05-03 US disclosed
US-20150297568-A1 Hepatitis C Virus Inhibitors BRISTOL MYERS SQUIBB CO (US) 2015-10-22 US disclosed
US-7838088-B2 Cyclic olefin-based polymer, and optical material, polarizing plate and liquid crystal display device using the same FUJIFILM CORPORATION (JP) 2010-11-23 US disclosed
US-7649118-B2 Process for preparing fluorine-containing norbornene derivative DAIKIN INDUSTRIES, LTD. (JP) 2010-01-19 US disclosed
US-20090040436-A1 Cyclic Olefin-Based Polymer, and Optical Material, Polarizing Plate and Liquid Crystal Display Device Using the Same FUJIFILM CORPORATION (JP) 2009-02-12 US disclosed
US-20090040436-A1 Cyclic Olefin-Based Polymer, and Optical Material, Polarizing Plate and Liquid Crystal Display Device Using the Same FUJIFILM CORPORATION (JP) 2009-02-12 US disclosed
US-20080299329-A1 CYCLIC OLEFIN POLYMER, OPTICAL MATERIAL, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPORATION (JP) 2008-12-04 US disclosed
US-20080299329-A1 CYCLIC OLEFIN POLYMER, OPTICAL MATERIAL, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY FUJIFILM CORPORATION (JP) 2008-12-04 US disclosed
US-7344820-B2 Chemically amplified polymer having pendant group with dicyclohexyl and resist composition comprising the same DONGJIN SEMICHEM CO., LTD. (KR) 2008-03-18 US disclosed
US-20070129576-A1 Process for preparing fluorine-containing norbornene derivative DAIKIN INDUSTRIES, LTD. 2007-06-07 US disclosed
US-7186773-B2 Process for preparing fluorine-containing norbornene derivative DAIKIN INDUSTRIES, LTD. (JP) 2007-03-06 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-20110308555-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 P2RX7 246/4885CYP2D6 792/4885CYP2C19 354/4885
US-20070129576-A1 Process for preparing fluorine-containing norbornene derivative ADH1A, FLNA, FFAR2 P2RX7 4397/4885CYP2D6 1459/4885CYP2C19 1106/4885
US-20160199355-A1 HEPATITIS C VIRUS INHIBITORS HAVCR2, MAVS, EIF2AK2 P2RX7 4283/4885CYP2D6 2878/4885CYP2C19 4064/4885
US-20150297568-A1 Hepatitis C Virus Inhibitors HAVCR2, MAVS, EIF2AK2 P2RX7 4283/4885CYP2D6 2878/4885CYP2C19 4064/4885
US-20160158200-A1 Combinations of Hepatitis C Virus Inhibitors HAVCR2, EIF2AK2, MAVS P2RX7 4396/4885CYP2D6 3573/4885CYP2C19 4541/4885
US-20200115400-A1 METHOD FOR PRODUCING SILICON COMPOUND, AND SILICON COMPOUND SI, SIK1, CA1 P2RX7 4866/4885CYP2D6 2112/4885CYP2C19 2529/4885

“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.