SCHEMBL430323

SCHEMBL430323

CCOc1nccnc1C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
LRRK2 Q5S007 1/20 0.36
GRM5 P41594 1/20 0.36
PDE1A P54750 4/20 0.34
PDE1B Q01064 4/20 0.34
PDE1C Q14123 4/20 0.34
ALDH1A1 P00352 1/20 0.33
SLC6A2 P23975 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
MPO P05164 1/20 0.33
NQO1 P15559 1/20 0.32
SLC6A4 P31645 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
POLB P06746 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL23251410 0.83 HPGD (0.39) HPGDSMN1; SMN2LRRK2GRM5PDE1A
SCHEMBL7598688 0.78 HPGD (0.52) HPGDSMN1; SMN2LRRK2GRM5ALDH1A1
SCHEMBL29483319 0.77 CYP2D6 (0.38) ALDH1A1KMT2AMEN1
SCHEMBL111252 0.77 CYP2D6 (0.38) ALDH1A1KMT2AMEN1
SCHEMBL27305156 0.76 LRRK2 (0.36) LRRK2ALDH1A1KMT2AMEN1L3MBTL1
Ammonia Solution, Strong SCHEMBL28789679 0.76 HPGD (0.50) HPGDSMN1; SMN2LRRK2GRM5ALDH1A1
SCHEMBL2732228 0.72 PIK3CG (0.31)
SCHEMBL9166315 0.72 CCR4 (0.33) HPGDSMN1; SMN2KMT2AMEN1NQO1
SCHEMBL22193276 0.71 HPGD (0.37) HPGDSMN1; SMN2
SCHEMBL11951662 0.71 PDE1A (0.44) HPGDSMN1; SMN2PDE1APDE1BPDE1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11504443-B2 Odor-modulating agent and odor-modulating method YAMAMOTO PERFUMERY CO., LTD. (JP) 2022-11-22 US claimed
US-11399558-B2 Rebaudioside-D containing sweetener compositions HEARTLAND CONSUMER PRODUCTS LLC (US) 2022-08-02 US claimed
US-11365370-B2 Fragrance compositions THE PROCTER & GAMBLE COMPANY (US) 2022-06-21 US claimed
CN-111565764-A Odor conversion agent for conversion of odor of asphalt, sludge, sewage, ginkgo biloba, compost, marine animal, vegetable, garbage or coating, and odor conversion method for conversion of odor of asphalt, sludge, sewage, ginkgo biloba, compost, marine animal, vegetable, garbage or coating 山本香料株式会社 2020-08-21 CN claimed
EP-3264917-B1 REBAUDIOSIDE-D CONTAINING SWEETENER COMPOSITIONS HEARTLAND CONSUMER PRODUCTS LLC (US) 2020-06-24 EP claimed
US-20190175777-A1 ODOR-MODULATING AGENT AND ODOR-MODULATING METHOD YAMAMOTO PERFUMERY CO., LTD. (JP) 2019-06-13 US claimed
EP-3467078-A1 ODOR-MODULATING AGENT AND ODOR-MODULATING METHOD Yamamoto Perfumery Co. Ltd. (JP) 2019-04-10 EP claimed
US-9949911-B2 Antiperspirant and deodorant compositions THE PROCTER & GAMBLE COMPANY (US) 2018-04-24 US claimed
EP-3264917-A1 REBAUDIOSIDE-D CONTAINING SWEETENER COMPOSITIONS Heartland Consumer Products, LLC (US) 2018-01-10 EP claimed
US-20170312204-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS PROCTER & GAMBLE (US) 2017-11-02 US claimed
US-20140170101-A1 Antiperspirant and Deodorant Compositions THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 US claimed
US-20140170194-A1 FRAGRANCE MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 US claimed
WO-2014093819-A2 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2014-06-19 WO claimed
EP-2068655-A1 SOLID UNIT DOSE, SWEETENING COMPOSITIONS McNeil Nutritionals, LLC (US) 2009-06-17 EP claimed
EP-1931219-A2 SWEETENER AND AROMA COMPOSITIONS McNeil Nutritionals, LLC (US) 2008-06-18 EP claimed
WO-2008036234-A1 SOLID UNIT DOSE, SWEETENING COMPOSITIONS MCNEIL NUTRITIONALS, LLC (US) 2008-03-27 WO claimed
US-20080069939-A1 SOLID, UNIT DOSE, SWEETENING COMPOSITIONS MCNEIL NUTRITIONALS, LLC 2008-03-20 US claimed
WO-2007033066-A2 SWEETENER AND AROMA COMPOSITIONS MCNEIL NUTRITIONALS, LLC (US) 2007-03-22 WO claimed
US-20070059420-A1 Sweetener and aroma compositions MCNEIL NUTRITIONALS, LLC 2007-03-15 US claimed
US-20070059418-A1 Self-mixing tabletop sweetener MCNEIL NUTRITIONALS, LLC 2007-03-15 US claimed

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-20140170101-A1 Antiperspirant and Deodorant Compositions LPO, GPX4, DEK HPGD 291/4885SMN1; SMN2 4196/4885LRRK2 4842/4885
US-20170312204-A1 ANTIPERSPIRANT AND DEODORANT COMPOSITIONS LPO, GPX4, DEK HPGD 291/4885SMN1; SMN2 4196/4885LRRK2 4842/4885

“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.