SCHEMBL631537

SCHEMBL631537

O=C1CCCc2ccsc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.42
MAOB P27338 3/20 0.42
CYP2A6 P11509 1/20 0.42
NOS3 P29474 1/20 0.41
NOS2 P35228 1/20 0.41
KMT2A Q03164 2/20 0.40
CES1 P23141 1/20 0.38
PRKCI P41743 1/20 0.37
TAAR1 Q96RJ0 2/20 0.35
MAPK1 P28482 2/20 0.33
MAP3K14 Q99558 1/20 0.33
HSD17B1 P14061 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MEN1 O00255 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PNMT P11086 1/20 0.33
HTR1A P08908 2/20 0.33
ACHE P22303 2/20 0.33
HRH1 P35367 2/20 0.33
HRH4 Q9H3N8 2/20 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
SCHEMBL350515 0.86
SCHEMBL17225408 0.77 NOS3 (0.44) NOS3NOS2CES1TAAR1MAP3K14
SCHEMBL9404977 0.77
SCHEMBL8936321 0.75 CES1 (0.48) NOS3NOS2KMT2ACES1TAAR1
SCHEMBL10196360 0.74 NOS3 (0.41) NOS3NOS2TAAR1MAP3K14PNMT
SCHEMBL15763737 0.73 NOS3 (0.52) NOS3NOS2CES1TAAR1MAP3K14
SCHEMBL3974015 0.72 TSHR (0.38) NOS3NOS2CES1MAPK1ALDH1A1
SCHEMBL10159213 0.71 NOS3 (0.39) NOS3NOS2KMT2ATAAR1MAP3K14
SCHEMBL10514854 0.69 ALDH1A1 (0.35) CES1ALDH1A1
SCHEMBL828997 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260034093-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SUMITOMO PHARMA AMERICA, INC. (US) 2026-02-05 US disclosed
EP-4642784-A1 HETEROCYCLIC AND HETEROARYL COMPOUNDS AS INHIBITORS OF NLRP3 PTC Therapeutics, Inc. (US) 2025-11-05 EP disclosed
US-12185626-B2 Chemical compounds, optoelectronic elements comprising at least one new chemical compound, and use of new chemical compounds in an optoelectronic element HELIATEK GMBH (DE) 2024-12-31 US disclosed
EP-3890041-B1 NEW CHEMICAL COMPOUNDS, OPTOELECTRONIC ELEMENTS COMPRISING AT LEAST ONE NEW CHEMICAL COMPOUND, AND USE OF NEW CHEMICAL COMPOUNDS IN AN OPTOELECTRONIC ELEMENT HELIATEK GMBH (DE) 2024-12-04 EP disclosed
US-20240358675-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SUMITOMO PHARMA AMERICA, INC. (US) 2024-10-31 US disclosed
WO-2024145623-A1 HETEROCYCLIC AND HETEROARYL COMPOUNDS AS INHIBITORS OF NLRP3 PTC THERAPEUTICS, INC. (US) 2024-07-04 WO disclosed
CN-118165002-A Polycyclic compounds and methods of use thereof 桑诺维恩药品公司 2024-06-11 CN disclosed
EP-3252057-B1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2024-03-27 EP disclosed
EP-3880659-B1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2024-01-03 EP disclosed
US-20230165146-A1 CHEMICAL COMPOUNDS, OPTOELECTRONIC ELEMENTS COMPRISING AT LEAST ONE NEW CHEMICAL COMPOUND, AND USE OF NEW CHEMICAL COMPOUNDS IN AN OPTOELECTRONIC ELEMENT HELIATEK GMBH (DE) 2023-05-25 US disclosed
US-4332724-A OXIDATION IN PRESENCE OF COBALT CATALYST AMERICAN CYANAMID CO. (US) 1982-06-01 US disclosed
US-4332724-A OXIDATION IN PRESENCE OF COBALT CATALYST AMERICAN CYANAMID CO. (US) 1982-06-01 US disclosed
US-4332724-A OXIDATION IN PRESENCE OF COBALT CATALYST AMERICAN CYANAMID CO. (US) 1982-06-01 US disclosed
US-4254268-A OXIDIZED BY POTASSIUM PERMANGANATE AMERICAN CYANAMID COMPANY (US) 1981-03-03 US disclosed
US-4199510-A Process for oxidation of 4-amidotetrahydrobenzo [b]-thiophenes to 7-keto derivatives with cobaltic salts AMERICAN CYANAMID COMPANY (US) 1980-04-22 US disclosed
US-4199510-A Process for oxidation of 4-amidotetrahydrobenzo [b]-thiophenes to 7-keto derivatives with cobaltic salts AMERICAN CYANAMID COMPANY (US) 1980-04-22 US disclosed
US-4154740-A HERBICIDES, ANIMAL GROWTH REGULATORS AMERICAN CYANAMID COMPANY (US) 1979-05-15 US disclosed
US-4125539-A CHEMICAL INTERMEDIATES FOR ANIMAL GROWTH PROMOTERS AMERICAN CYANAMID COMPANY (US) 1978-11-14 US disclosed
US-4096155-A ANIMAL GROWTH PROMOTERS AMERICAN CYANAMID COMPANY (US) 1978-06-20 US disclosed
US-4075228-A INTERMEDIATES FOR ANIMAL GROWTH PROMOTERS AMERICAN CYANAMID COMPANY (US) 1978-02-21 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 (4 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-20240358675-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF GRIN2C, NLN, COMT MAOA 23/4885MAOB 11/4885CYP2A6 533/4885
US-20230165146-A1 CHEMICAL COMPOUNDS, OPTOELECTRONIC ELEMENTS COMPRISING AT LEAST ONE NEW CHEMICAL COMPOUND, AND USE OF NEW CHEMICAL COMPOUNDS IN AN OPTOELECTRONIC ELEMENT ETV6, ALK, CHRM3 MAOA 507/4885MAOB 242/4885CYP2A6 22/4885
US-20260034093-A1 MULTICYCLIC COMPOUNDS AND METHODS OF USE THEREOF SLC6A3, SLC6A11, SLC6A13 MAOA 112/4885MAOB 204/4885CYP2A6 1156/4885
US-12185626-B2 Chemical compounds, optoelectronic elements comprising at least one new chemical compound, and use of new chemical compounds in an optoelectronic element ETV6, ALK, CHRM3 MAOA 507/4885MAOB 242/4885CYP2A6 22/4885

“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.