SCHEMBL161298

SCHEMBL161298

NN1CSc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.38
MAOA P21397 1/20 0.37
BCHE P06276 2/20 0.35
ACHE P22303 1/20 0.35
HSD17B3 P37058 1/20 0.35
COMT P21964 1/20 0.34
KDM4E B2RXH2 2/20 0.33
GSK3B P49841 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PIM1 P11309 1/20 0.32
GAA P10253 1/20 0.32
NOX1 Q9Y5S8 2/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
CHRM3 P20309 1/20 0.32
SLC6A2 P23975 1/20 0.32

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
SCHEMBL3315465 0.78 NOTUM (0.51) NOTUMKDM4EGSK3BALDH1A1GAA
Hydrochloric Acid SCHEMBL5636567 0.77 NOTUM (0.50) NOTUMKDM4EGSK3BALDH1A1GAA
SCHEMBL5637075 0.75 NOTUM (0.45) NOTUMBCHEKDM4EGSK3BGAA
SCHEMBL4708088 0.74 NOTUM (0.37) NOTUMMAOABCHEACHEHSD17B3
Hydrochloric Acid SCHEMBL5638604 0.74 NOTUM (0.44) NOTUMBCHEKDM4EGSK3BALDH1A1
SCHEMBL5135034 0.73 NOTUM (0.38) NOTUMMAOABCHEACHEHSD17B3
SCHEMBL2513920 0.73 NOTUM (0.42) NOTUMMAOABCHEACHEHSD17B3
SCHEMBL627227 0.73 MAOA (0.46) NOTUMMAOABCHEHSD17B3KDM4E
SCHEMBL4538011 0.73 NOTUM (0.38) NOTUMMAOABCHEACHEHSD17B3
SCHEMBL6096618 0.73 NOTUM (0.42) NOTUMMAOABCHEACHEHSD17B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4329888-A1 2-AMINOBENZOTHIAZOLE COMPOUNDS AND METHODS OF USE THEREOF Amgen Inc. (US) 2024-03-06 EP claimed
CN-108026105-A Tgf beta receptor antagonists 百时美施贵宝公司 2018-05-11 CN claimed
EP-2611907-A2 DIFFERENTIATION OF PLURIPOTENT STEM CELLS Janssen Biotech, Inc. (US) 2013-07-10 EP claimed
WO-2012030540-A2 DIFFERENTIATION OF PLURIPOTENT STEM CELLS JANSSEN BIOTECH, INC. (US) 2012-03-08 WO claimed
US-20250177359-A1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER AND INFLAMMATORY CONDITIONS OULUN YLIOPISTO (FI) 2025-06-05 US disclosed
EP-4469046-A1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER AND INFLAMMATORY CONDITIONS Oulun Yliopisto (FI) 2024-12-04 EP disclosed
CN-112585136-B Urea compounds and compositions as SMARCA2/BRM atpase inhibitors 诺华股份有限公司 2024-06-25 CN disclosed
CN-110719778-B Compositions and methods for treating depression 才思治疗公司 2024-06-18 CN disclosed
US-11958846-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors NOVARTIS AG (CH) 2024-04-16 US disclosed
EP-4329888-A1 2-AMINOBENZOTHIAZOLE COMPOUNDS AND METHODS OF USE THEREOF Amgen Inc. (US) 2024-03-06 EP disclosed
WO-2023217230-A1 KINESIN KIF18A INHIBITOR AND USE THEREOF 上海湃隆生物科技有限公司 2023-11-16 WO disclosed
WO-2023144450-A1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER AND INFLAMMATORY CONDITIONS OULUN YLIOPISTO (FI) 2023-08-03 WO disclosed
US-5358536-A Dyestuff for heat-sensitive transfer record and transfer sheet containing same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1994-10-25 US disclosed
EP-0529600-A1 Process for the preparation of 2-aminobenzothiazoles HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-03 EP disclosed
EP-0526170-A2 Dyestuff for heat-sensitive transfer record and transfer sheet containing same MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-02-03 EP disclosed
US-4988605-A Heat and chemical resistant polymers for printed circuits MITSUBISHI DENKI KABUSHIKI KAISHA (JP) 1991-01-29 US disclosed
US-4766110-A INHIBITS ANGIOTENSIN CONVERTING ENZYME, HYPOTENSIVE AGENTS RYAN JAMES W (US) 1988-08-23 US disclosed
EP-0073143-B1 NOVEL COMPLEX AMIDO AND IMIDO DERIVATIVES OF CARBOXYALKYL PEPTIDES AND THIOETHERS AND ETHERS OF PEPTIDES Ryan, James Walter (US) 1985-11-21 EP disclosed
EP-0073143-A2 Novel complex amido and imido derivatives of carboxyalkyl peptides and thioethers and ethers of peptides Ryan, James Walter (US) 1983-03-02 EP disclosed
EP-0028406-A1 Copolymerizable, ultraviolet light absorber N-benzothiazoloazines GAF CORPORATION (US) 1981-05-13 EP 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 (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-11958846-B2 Urea compounds and compositions as SMARCA2/BRM ATPase inhibitors SMARCC1, SMARCC2, SMARCA1 NOTUM 4132/4885MAOA 3483/4885BCHE 1458/4885
US-20250177359-A1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER AND INFLAMMATORY CONDITIONS NAMPT, NADK, NQO1 NOTUM 1798/4885MAOA 475/4885BCHE 3116/4885

“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.