SCHEMBL26416381

SCHEMBL26416381

CN1c2ccccc2N(C)C1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN2 P17706 1/20 0.42
▸ PTPN1 P18031 1/20 0.42
▸ PDGFRB P09619 1/20 0.38
▸ GPR3 P46089 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ GAA P10253 2/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ MAOA P21397 1/20 0.33
▸ EGFR P00533 1/20 0.33
▸ HDAC4 P56524 1/20 0.32
▸ HDAC7 Q8WUI4 1/20 0.32
▸ HDAC5 Q9UQL6 1/20 0.32
▸ ADRA2C P18825 1/20 0.32
▸ ACHE P22303 2/20 0.32
▸ PAX8 Q06710 1/20 0.31
▸ MCL1 Q07820 1/20 0.31

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
SCHEMBL28138831 0.82 PTPN2 (0.35) PTPN2PTPN1PDGFRBGPR3LMNA
SCHEMBL28331891 0.79 PTPN2 (0.38) PTPN2PTPN1PDGFRBGPR3LMNA
SCHEMBL28138899 0.78 BRD4 (0.40) LMNAALDH1A1ALOX12HTT
SCHEMBL23917940 0.78 PTPN2 (0.44) PTPN2PTPN1PDGFRBGPR3LMNA
SCHEMBL28138322 0.77 PTPN2 (0.32) PTPN2PTPN1GPR3
SCHEMBL28138887 0.77 PTPN2 (0.32) PTPN2PTPN1GPR3
SCHEMBL28138835 0.74 BRD4 (0.37) LMNAALDH1A1ALOX12HTT
SCHEMBL21250753 0.73 PDGFRB (0.46) PTPN2PTPN1PDGFRBGPR3LMNA
SCHEMBL28138290 0.73 PTPN2 (0.34) PTPN2PTPN1PDGFRB
SCHEMBL28138284 0.73 PTPN2 (0.34) PTPN2PTPN1PDGFRB

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-20230125434-A1 METHOD FOR PRODUCING MONOSULFOXIDE DERIVATIVE KUMIAI CHEMICAL INDUSTRY CO. LTD. (JP) 2023-04-27 — — 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-20230125434-A1 METHOD FOR PRODUCING MONOSULFOXIDE DERIVATIVE TST, STS, MPST PTPN2 1113/4885PTPN1 1590/4885PDGFRB 3705/4885

“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.

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