SCHEMBL2790352

SCHEMBL2790352

CCOC(=O)CNC(=S)Nc1nc2ccc(F)cc2s1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.66
MAPT P10636 6/20 0.61
SMN1; SMN2 Q16637 6/20 0.61
RAB9A P51151 6/20 0.61
NPC1 O15118 5/20 0.61
HPGD P15428 5/20 0.61
ALDH1A1 P00352 4/20 0.61
GAA P10253 2/20 0.61
ALPL P05186 1/20 0.61
PDPK1 O15530 1/20 0.57
DYRK1A Q13627 1/20 0.57
KDM4E B2RXH2 5/20 0.57
LMNA P02545 4/20 0.57
NPSR1 Q6W5P4 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
HTT P42858 2/20 0.51
TNF P01375 1/20 0.51
NR2F2 P24468 1/20 0.51

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
SCHEMBL2791688 0.89 PTPN1 (0.69) PTPN1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2793238 0.89 PTPN1 (0.65) PTPN1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2793299 0.87 PTPN1 (0.66) PTPN1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2790995 0.86 MAPT (0.67) MAPTSMN1; SMN2RAB9ANPC1HPGD
SCHEMBL9988447 0.86 NPC1 (0.61) MAPTSMN1; SMN2RAB9ANPC1HPGD
SCHEMBL2817268 0.84 MAPK1 (0.47) PTPN1MAPTSMN1; SMN2RAB9ANPC1
SCHEMBL2792239 0.84 MAPK1 (0.69) MAPTSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL2842399 0.76 MAPT (0.58) MAPTSMN1; SMN2HPGDALDH1A1GAA
SCHEMBL2791913 0.76 PTPN1 (0.69) PTPN1SMN1; SMN2RAB9ANPC1DYRK1A
SCHEMBL17776540 0.75 PDPK1 (0.72) PTPN1MAPTSMN1; SMN2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012481-B2 Benzoarylureido compounds, and composition for prevention or treatment of neurodegenerative brain disease containing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-04-21 US disclosed
US-9012481-B2 Benzoarylureido compounds, and composition for prevention or treatment of neurodegenerative brain disease containing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-04-21 US disclosed
US-9012481-B2 Benzoarylureido compounds, and composition for prevention or treatment of neurodegenerative brain disease containing the same KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-04-21 US disclosed
US-20110319456-A1 BENZOARYLUREIDO COMPOUNDS, AND COMPOSITION FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASE CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-12-29 US disclosed
US-20110319456-A1 BENZOARYLUREIDO COMPOUNDS, AND COMPOSITION FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASE CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-12-29 US disclosed
US-20110319456-A1 BENZOARYLUREIDO COMPOUNDS, AND COMPOSITION FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASE CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2011-12-29 US disclosed
WO-2010077068-A2 BENZOARYLUREIDO COMPOUNDS, AND COMPOSITION FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASE CONTAINING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2010-07-08 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 (1 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-20110319456-A1 BENZOARYLUREIDO COMPOUNDS, AND COMPOSITION FOR PREVENTION OR TREATMENT OF NEURODEGENERATIVE BRAIN DISEASE CONTAINING THE SAME HTT, PSEN1, PYGB PTPN1 4064/4885MAPT 8/4885SMN1; SMN2 186/4885

“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.