SCHEMBL4942499

SCHEMBL4942499

CS(=O)(=O)O.N=C(N)NC(=O)c1ccc(-c2cc(C(F)(F)F)ccc2Cl)o1

nearest known ligand 0.64

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 14)

geneUniProtsupporting neighboursconfidence
GHSR known ✓ Q92847 1/20 0.41
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
S1PR4 O95977 10/20 0.43
S1PR2 O95136 5/20 0.43
S1PR3 Q99500 3/20 0.43
S1PR5 Q9H228 3/20 0.41
S1PR1 P21453 2/20 0.41
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
SLC9A1 P19634 1/20 0.40

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
SCHEMBL4944262 0.95 MEN1 (0.55) MEN1KMT2AHTTSMN1; SMN2S1PR4
SCHEMBL4944695 0.81 CYP1A2 (0.62) MEN1KMT2ASMN1; SMN2KDM4EALDH1A1
SCHEMBL4946319 0.80 SLC9A1 (0.61) S1PR4S1PR2S1PR3S1PR5S1PR1
SCHEMBL4936883 0.78 SMN1; SMN2 (0.61) HTTSMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL13078465 0.77 MEN1 (0.56) MEN1KMT2AHTTSMN1; SMN2S1PR4
SCHEMBL4942506 0.77 SLC9A1 (0.50) MEN1KMT2AHTTSMN1; SMN2KDM4E
SCHEMBL4945635 0.76 SLC9A1 (0.56) S1PR4S1PR2S1PR3S1PR5S1PR1
SCHEMBL4944763 0.76 MAPKAPK2 (0.52) KDM4EALDH1A1SLC9A1
SCHEMBL3063301 0.76 MEN1 (0.54) MEN1KMT2AHTTSMN1; SMN2S1PR4
SCHEMBL4946316 0.76 MEN1 (0.57) MEN1KMT2AHTTSMN1; SMN2KDM4E

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 GHSR 2931/4885MEN1 2726/4885KMT2A 4059/4885

“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.