SCHEMBL23649331

SCHEMBL23649331

CCCCOc1ccc(S(=O)(=O)NCCCN2CCOCC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.67
POLB P06746 4/20 0.66
NPSR1 Q6W5P4 1/20 0.66
MAPK1 P28482 2/20 0.66
HRH3 Q9Y5N1 2/20 0.66
ALDH1A1 P00352 1/20 0.66
CYP1A2 P05177 1/20 0.66
CHRM2 P08172 1/20 0.66
CHRM1 P11229 1/20 0.66
HTR2A P28223 1/20 0.66
SCN1A P35498 1/20 0.66
HTR2B P41595 1/20 0.66
KCNH2 Q12809 1/20 0.66
SCN2A Q99250 1/20 0.66
SIGMAR1 Q99720 1/20 0.66
SCN3A Q9NY46 1/20 0.66
USP2 O75604 1/20 0.64
LMNA P02545 1/20 0.64
MEN1 O00255 1/20 0.61
CYP3A4 P08684 1/20 0.59

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
SCHEMBL25758379 0.88 HTR7 (0.53) KMT2APOLBNPSR1MAPK1HRH3
SCHEMBL13285873 0.85 HTR7 (0.56) KMT2AMAPK1ALDH1A1KCNH2SIGMAR1
SCHEMBL23648883 0.84 HTR7 (0.56) POLBNPSR1HRH3HTR2AHTR7
SCHEMBL12509429 0.83 KMT2A (0.73) KMT2APOLBNPSR1MAPK1ALDH1A1
SCHEMBL9885366 0.83 POLB (0.78) KMT2APOLBNPSR1MAPK1ALDH1A1
SCHEMBL25758396 0.82 HTR7 (0.73) KMT2APOLBALDH1A1HTR2ALMNA
Pramoxine SCHEMBL29048599 0.81 ALDH1A1 (0.83) KMT2AMAPK1HRH3ALDH1A1CYP1A2
Pramoxine SCHEMBL26020 0.81 ALDH1A1 (1.00) KMT2AMAPK1HRH3ALDH1A1CYP1A2
SCHEMBL6107281 0.80 KMT2A (0.76) KMT2APOLBNPSR1MAPK1ALDH1A1
SCHEMBL3326014 0.80 KMT2A (0.76) KMT2APOLBNPSR1HRH3ALDH1A1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF PIMEDBIO, INC. (KR) 2023-05-11 US claimed
EP-4065553-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF Daegu-Gyeongbuk Medical Innovation Foundation (KR) 2022-10-05 EP claimed
CN-114981241-A Novel compound, preparation method and application thereof 大邱庆北尖端医疗产业振兴财团 2022-08-30 CN claimed
WO-2021145729-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) 2021-07-22 WO claimed
US-12583818-B2 Compound, preparation method thereof, and use thereof DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) 2026-03-24 US disclosed
CN-114981241-B Novel compounds, process for their preparation and their use 大邱庆北尖端医疗产业振兴财团 2024-11-19 CN disclosed
US-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF PIMEDBIO, INC. (KR) 2023-05-11 US disclosed
US-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF PIMEDBIO, INC. (KR) 2023-05-11 US disclosed
EP-4065553-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF Daegu-Gyeongbuk Medical Innovation Foundation (KR) 2022-10-05 EP disclosed
CN-114981241-A Novel compound, preparation method and application thereof 大邱庆北尖端医疗产业振兴财团 2022-08-30 CN disclosed
WO-2021145729-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) 2021-07-22 WO disclosed
WO-2021145729-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) 2021-07-22 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 (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-12583818-B2 Compound, preparation method thereof, and use thereof TYRO3, TH, SRMS KMT2A 1594/4885POLB 4570/4885NPSR1 44/4885
US-20230142654-A1 NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF TYR, TYRO3, TH KMT2A 1383/4885POLB 4758/4885NPSR1 698/4885

“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.