SCHEMBL956562

SCHEMBL956562

Cc1ccsc1CC(C)C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
ALOX5 P09917 2/20 0.42
ADRA1D P25100 2/20 0.41
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
RIPK1 Q13546 1/20 0.37
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GSK3B P49841 1/20 0.34
GAA P10253 1/20 0.34
KDM4E B2RXH2 1/20 0.33
HSD11B1 P28845 1/20 0.33

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
SCHEMBL13692403 0.83 ALOX5 (0.47) ALDH1A1ALOX5ADRA1D
SCHEMBL6642441 0.83 ALOX5 (0.47) ALDH1A1ALOX5ADRA1D
SCHEMBL10642812 0.78 ALDH1A1 (0.38) ALDH1A1ALOX5ADRA1DLMNAMAPT
SCHEMBL11421425 0.77 GABRA1 (0.40) ALDH1A1
SCHEMBL10566217 0.77 ALOX5 (0.46) ALDH1A1ALOX5ADRA1DRIPK1NPC1
SCHEMBL23877337 0.76 KEAP1 (0.31)
SCHEMBL12702042 0.76 FBP1 (0.32)
SCHEMBL9036511 0.76 GABRA1 (0.39) ALDH1A1ALOX5LMNAMAPTNPC1
SCHEMBL22863972 0.76 SLC6A3 (0.41) ALDH1A1LMNAMAPT
SCHEMBL12434723 0.76 ADRA1D (0.40) ADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250084074-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS MERCK PATENT GMBH (DE) 2025-03-13 US claimed
US-20250214978-A1 AT2R AGONIST Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2025-07-03 US disclosed
WO-2025044926-A1 THIENYLSULFONYL CARBAMATES AS AT2R AGONISTS 武汉人福创新药物研发中心有限公司 2025-03-06 WO disclosed
CN-119504723-A Thiophene sulfonyl carbamates as AT2R agonists 武汉人福创新药物研发中心有限公司 2025-02-25 CN disclosed
EP-4506345-A1 AT2R AGONIST Wuhan Humanwell Innovative Drug Research and Development Center Limited Company (CN) 2025-02-12 EP disclosed
CN-116891464-A AT2R agonist 武汉人福创新药物研发中心有限公司 2023-10-17 CN disclosed
WO-2023193733-A1 AT2R AGONIST 武汉人福创新药物研发中心有限公司 2023-10-12 WO disclosed
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 US disclosed
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. 2023-09-14 US disclosed
US-11180474-B2 Dimethoxyphenyl substituted indole compounds as TLR7, TLR8 or TLR9 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2021-11-23 US disclosed
US-20080176815-A1 Compounds that interact with kinases ALCHEMIA LIMITED (AU) 2008-07-24 US disclosed
WO-2007137962-A1 THIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-12-06 WO disclosed
US-20070281979-A1 Fructose-1,6-bisphosphatase (FBPase) inhibitors, such as N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]3(difluoromethoxy)benzenesulfonamide, used as antidiabetic agents HOFFMANN-LA ROCHE INC. 2007-12-06 US disclosed
US-7291623-B2 Compounds that interact with kinases ALCHEMIA LIMITED (AU) 2007-11-06 US disclosed
US-20060161008-A1 Chloromethylation of thiophene, using aqueous concentrated hydrochloric acid, gaseous hydrogen chloride and paraformaldehyde, in the presence of acetone or methyl-ethyl-ketone or methyl-isobutyl-ketone to produce 2-chloro-methyl-thiophene SANOFI (FR) 2006-07-20 US disclosed
CN-1260224-C Chloromethylation of thiophene SANOF SYNTHELABO (FR) 2006-06-21 CN disclosed
EP-1392672-B1 CHLOROMETHYLATION OF THIOPHENE SANOFI AVENTIS (FR) 2005-05-04 EP disclosed
CN-1511148-A Chloromethylation of thiophenes ��ŵ�Ѻϳ�ʵ���� 2004-07-07 CN disclosed
EP-1392672-A1 CHLOROMETHYLATION OF THIOPHENE Sanofi-Aventis (FR) 2004-03-03 EP disclosed
WO-2002094806-A1 CHLOROMETHYLATION OF THIOPHENE SANOFI-SYNTHELABO (FR) 2002-11-28 WO 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 (7 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-20250084074-A1 SUBSTITUTED HETEROCYCLES AS HSET INHIBITORS VHL, CDKN1A, CCNI ALDH1A1 1680/4885ALOX5 3687/4885ADRA1D 4770/4885
US-20250214978-A1 AT2R AGONIST AGTR1, AGTR2, AVPR2 ALDH1A1 2365/4885ALOX5 2253/4885ADRA1D 13/4885
US-20230285573-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE NEDD4, CBL, UBQLN2 ALDH1A1 4642/4885ALOX5 4711/4885ADRA1D 4243/4885
US-20080176815-A1 Compounds that interact with kinases MAP3K6, MAP3K20, MAP4K2 ALDH1A1 3275/4885ALOX5 4292/4885ADRA1D 3618/4885
US-20070281979-A1 Fructose-1,6-bisphosphatase (FBPase) inhibitors, such as N-[(5-bromo-1,3-thiazol-2-yl)carbamoyl]3(difluoromethoxy)benzenesulfonamide, used as antidiabetic agents FBP1, PFKFB1, PFKFB3 ALDH1A1 565/4885ALOX5 3688/4885ADRA1D 2205/4885
US-20060161008-A1 Chloromethylation of thiophene, using aqueous concentrated hydrochloric acid, gaseous hydrogen chloride and paraformaldehyde, in the presence of acetone or methyl-ethyl-ketone or methyl-isobutyl-ketone to produce 2-chloro-methyl-thiophene TPMT, MCCC2, MGMT ALDH1A1 522/4885ALOX5 1894/4885ADRA1D 3003/4885
US-11180474-B2 Dimethoxyphenyl substituted indole compounds as TLR7, TLR8 or TLR9 inhibitors TLR9, TLR7, TLR8 ALDH1A1 3767/4885ALOX5 2221/4885ADRA1D 1174/4885

“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.