SCHEMBL4881570

SCHEMBL4881570

CS(=O)(=O)O.N=C1OCCN1c1ccc(NC(=O)c2scc(-c3ccc(Cl)cn3)c2C(N)=O)cc1

nearest known ligand 0.39

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 known ✓ P00734 2/20 0.39
KDR known ✓ P35968 1/20 0.33
F10 P00742 6/20 0.37
MAPT P10636 3/20 0.35
RAB9A P51151 3/20 0.35
LMNA P02545 2/20 0.35
HTT P42858 2/20 0.35
NPC1 O15118 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MITF O75030 1/20 0.35
TP53 P04637 1/20 0.35
XBP1 P17861 1/20 0.35
MAPK1 P28482 1/20 0.35
UBE2N P61088 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TLR9 Q9NR96 1/20 0.35
BTK Q06187 1/20 0.33
KLKB1 P03952 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MEN1 O00255 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
SCHEMBL4885429 0.94 F10 (0.37) F2F10MAPTRAB9ALMNA
SCHEMBL4886052 0.77 F2 (0.48) F2F10ALDH1A1MAPK1KLKB1
SCHEMBL4880798 0.75 RAB9A (0.38) F10MAPTRAB9ALMNAHTT
SCHEMBL4884191 0.74 F10 (0.45) F2F10MAPTRAB9ALMNA
SCHEMBL4884938 0.74 F10 (0.42) F2F10MAPTRAB9ALMNA
SCHEMBL4873912 0.74 SCN9A (0.39) F10MAPTRAB9ALMNAHTT
SCHEMBL4882290 0.72 F10 (0.43) F10MAPTRAB9ALMNANPC1
SCHEMBL5237784 0.72 F2 (0.49) F2F10RAB9ANPC1KLKB1
SCHEMBL8260892 0.72 F2 (0.49) F2F10RAB9ANPC1KLKB1
SCHEMBL3621443 0.71 F10 (0.42) F10MAPTRAB9ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214533-A1 Cyclic Iminocarbamates And Their Use BAYER HEALTHCARE AG (DE) 2008-09-04 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 (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-20080214533-A1 Cyclic Iminocarbamates And Their Use F2, UQCRB, F12 F2 1/4885KDR 2178/4885F10 26/4885

“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.