SCHEMBL16396338

SCHEMBL16396338

CS(=O)(=O)Nc1cc2cc(C(=O)O)sc2cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.46
BCL2L1 Q07817 1/20 0.40
PTPN2 P17706 2/20 0.39
MAPK14 Q16539 1/20 0.37
STING1 Q86WV6 2/20 0.36
MCL1 Q07820 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC10 Q969S8 1/20 0.35
HDAC11 Q96DB2 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
MMP2 P08253 1/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL16395990 0.89 MAPT (0.46) PTPN2MAPK14STING1HDAC3HDAC4
SCHEMBL16395966 0.86 GPR35 (0.44) GPR35BCL2L1PTPN2STING1HDAC3
SCHEMBL16396080 0.83 GPR35 (0.46) GPR35BCL2L1PTPN2MAPK14STING1
SCHEMBL16396235 0.83 PTPN2 (0.48) GPR35BCL2L1PTPN2MAPK14STING1
SCHEMBL16396069 0.81 STING1 (0.54) GPR35MAPK14STING1HDAC3HDAC4
SCHEMBL16396067 0.81 GPR35 (0.46) GPR35BCL2L1PTPN2MAPK14STING1
SCHEMBL16396294 0.78 GPR35 (0.36) GPR35BCL2L1PTPN2STING1
SCHEMBL34471930 0.77 GPR35 (0.63) GPR35BCL2L1PTPN2STING1MEN1
SCHEMBL17842813 0.77 GPR35 (0.63) GPR35BCL2L1PTPN2STING1MEN1
SCHEMBL16396914 0.76 MAPT (0.44) PTPN2STING1HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10562912-B2 Heterocyclic derivatives and use thereof C&C RESEARCH LABORATORIES (KR) 2020-02-18 US disclosed
EP-3004057-B1 HETEROCYCLIC DERIVATIVES AND THEIR USE AS STAT 3 INHIBITORS C&C RES LAB (KR) 2018-07-25 EP disclosed
US-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2016-04-21 US disclosed
EP-3004057-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C Research Laboratories (KR) 2016-04-13 EP disclosed
WO-2014196793-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF C&C RESEARCH LABORATORIES (KR) 2014-12-11 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-20160108056-A1 HETEROCYCLIC DERIVATIVES AND USE THEREOF STAT3, JAK2, STAT5A GPR35 2270/4885BCL2L1 786/4885PTPN2 329/4885
US-10562912-B2 Heterocyclic derivatives and use thereof STAT3, JAK2, STAT5A GPR35 2270/4885BCL2L1 786/4885PTPN2 329/4885

“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.