SCHEMBL3379956

SCHEMBL3379956

Cc1n[nH]cc1-c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT2 P31751 4/20 0.44
CHEK1 O14757 2/20 0.44
AKT1 P31749 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.39
HTT P42858 1/20 0.39
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38
PSMB5 P28074 2/20 0.38
SQOR Q9Y6N5 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
CYP2A6 P11509 1/20 0.38
CYP2B6 P20813 1/20 0.38
KMT2A Q03164 1/20 0.37
LRRK2 Q5S007 1/20 0.37
POLB P06746 1/20 0.36
METAP2 P50579 1/20 0.36
ADORA3 P0DMS8 1/20 0.36

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
SCHEMBL2419516 0.83 MEN1 (0.40) KMT2ALRRK2METAP2
SCHEMBL8809265 0.80 SMN1; SMN2 (0.42) AKT1HTTALDH1A1KMT2A
SCHEMBL8360337 0.79 DYRK1A (0.45) ALOX15KMT2ALRRK2
SCHEMBL1978092 0.79 SMN1; SMN2 (0.43) AKT2AKT1HTTALDH1A1JAK2
SCHEMBL17785560 0.79 KDR (0.39) CHEK1L3MBTL1ALDH1A1JAK2METAP2
SCHEMBL24962591 0.79 IKBKB (0.41) KMT2AMETAP2
SCHEMBL1978865 0.79 AKT2 (0.55) AKT2L3MBTL1ALDH1A1KMT2A
SCHEMBL8123127 0.77 RXRA (0.44) HTTALDH1A1KMT2APOLB
SCHEMBL8123308 0.77 MAP4K4 (0.45) ALDH1A1METAP2
SCHEMBL16115039 0.77 IKBKB (0.46) HTTALDH1A1ALOX15KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210253871-A1 CORROSION-RESISTANT CONDUCTIVE STRUCTURE AND CORROSION-RESISTANT COATING COMPOSITION TPK UNIVERSAL SOLUTIONS LIMITED (HK) 2021-08-19 US claimed
CN-111192857-A Corrosion-resistant conductive structure and corrosion-resistant coating composition 宸盛光电有限公司 2020-05-22 CN claimed
US-20190209441-A1 GEL NETWORK HAIR TREATMENT COMPOSITIONS WITH REDUCED ODOR WELLA OPERATIONS US, LLC 2019-07-11 US claimed
US-20190192408-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR WELLA OPERATIONS US, LLC 2019-06-27 US claimed
US-20190175476-A1 HAIR COLORING OR BLEACHING COMPOSITION WITH REDUCED ODOR WELLA OPERATIONS US, LLC 2019-06-13 US claimed
US-20190155975-A9 Antiperspirant and Deodorant Compositions Comprising Malodor Reduction Compositions THE PROCTER & GAMBLE COMPANY 2019-05-23 US claimed
WO-2018053183-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR NOXELL CORPORATION (US) 2018-03-22 WO claimed
WO-2018053065-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR THE PROCTER & GAMBLE COMPANY (US) 2018-03-22 WO claimed
EP-3295925-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR Noxell Corporation (US) 2018-03-21 EP claimed
WO-2018048933-A1 HAIR COLORING OR BLEACHING COMPOSITION WITH REDUCED ODOR NOXELL CORPORATION (US) 2018-03-15 WO claimed
US-20160090555-A1 CLEANING AND/OR TREATMENT COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2016-03-31 US claimed
WO-2016049394-A1 CLEANING AND/OR TREATMENT COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO claimed
WO-2016049455-A1 PERSONAL CARE COMPOSITIONS COMPRISING MALODOR REDUCTION COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2016-03-31 WO claimed
US-20160031935-A1 SMALL MOLECULE MODULATORS OF PCSK9 AND METHODS OF USE THEREOF NUCHEM THERAPEUTICS (CA) 2016-02-04 US claimed
EP-2961765-A1 SMALL MOLECULE MODULATORS OF PCSK9 AND METHODS OF USE THEREOF Adaerata, Limited Partnership (CA) 2016-01-06 EP claimed
WO-2014139008-A1 SMALL MOLECULE MODULATORS OF PCSK9 AND METHODS OF USE THEREOF ADAERATA, LIMITED PARTNERSHIP (CA) 2014-09-18 WO claimed
CN-101384240-A Hair colouring compositions PROCTER & GAMBLE (US) 2009-03-11 CN claimed
WO-1998033786-A9 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS 1998-12-30 WO claimed
WO-1998033786-A1 ACCELERATED CATALYSIS OF OLEFINIC EPOXIDATIONS THE SCRIPPS RESEARCH INSTITUTE (US) 1998-08-06 WO claimed
US-5468871-A Catalytic N-alkylation BASF AKTIENGESELLSCHAFT (DE) 1995-11-21 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-20190192408-A1 COMPOSITION FOR THE PERMANENT DEFORMATION OF HAIR HAVING REDUCED ODOUR MAL2, MSH6, OR51E2 AKT2 4680/4885CHEK1 2453/4885AKT1 4765/4885
US-20160031935-A1 SMALL MOLECULE MODULATORS OF PCSK9 AND METHODS OF USE THEREOF PCSK9, PCSK7, PCSK6 AKT2 870/4885CHEK1 3651/4885AKT1 681/4885

“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.