SCHEMBL4948246

SCHEMBL4948246

CS(=O)(=O)O.N=C(N)NC(=O)c1ccc(-c2ccccc2F)o1

nearest known ligand 0.54

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
RAB9A P51151 5/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
KDM4E B2RXH2 4/20 0.54
HSD17B10 Q99714 3/20 0.54
MAPK1 P28482 3/20 0.54
SLC9A1 P19634 2/20 0.53
MAPT P10636 4/20 0.53
ALDH1A1 P00352 3/20 0.53
TSHR P16473 1/20 0.53
ATM Q13315 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
NPC1 O15118 3/20 0.52
KMT2A Q03164 2/20 0.52
HPGD P15428 1/20 0.52
MGAM O43451 1/20 0.48
GAA P10253 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
OPRM1 P35372 1/20 0.47
OPRD1 P41143 1/20 0.47

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
SCHEMBL4952806 0.94 RAB9A (0.60) RAB9ASMN1; SMN2KDM4EHSD17B10MAPK1
SCHEMBL4942893 0.86 ALDH1A1 (0.55) KDM4EMAPK1SLC9A1MAPTALDH1A1
SCHEMBL4937491 0.86 SLC9A1 (0.55) RAB9ASMN1; SMN2KDM4EHSD17B10MAPK1
SCHEMBL4936883 0.85 SMN1; SMN2 (0.61) RAB9ASMN1; SMN2KDM4EHSD17B10MAPK1
SCHEMBL4939604 0.84 ALDH1A1 (0.56) RAB9ASMN1; SMN2KDM4EHSD17B10MAPK1
SCHEMBL4945173 0.84 SLC9A1 (0.61) RAB9ASMN1; SMN2KDM4EHSD17B10MAPK1
SCHEMBL4944299 0.82 S1PR4 (0.51) SMN1; SMN2KDM4EMAPK1SLC9A1MAPT
SCHEMBL4946322 0.81 SLC9A1 (0.57) RAB9ASMN1; SMN2KDM4EMAPK1SLC9A1
SCHEMBL4946626 0.79 SLC9A1 (0.58) RAB9ASMN1; SMN2KDM4EHSD17B10MAPK1
SCHEMBL4943942 0.79 PDE4B (0.47) RAB9ASMN1; SMN2KDM4EHSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7351843-B2 Furancarbonylguanidine derivatives, their preparation and pharmaceutical compositions containing them KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-04-01 US disclosed
US-20070299131-A1 Furancarbonylguanidine Derivatives, Their Preparation and Pharmaceutical Compositions Containing Them KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2007-12-27 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-20070299131-A1 Furancarbonylguanidine Derivatives, Their Preparation and Pharmaceutical Compositions Containing Them SLC9A1, NHERF1, SLC5A1 RAB9A 699/4885SMN1; SMN2 1875/4885KDM4E 3451/4885

“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.