SCHEMBL21378321

SCHEMBL21378321

O=C(S)Sc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.49
PDK1 Q15118 1/20 0.44
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
HTR3E A5X5Y0 1/20 0.41
HTR3B O95264 1/20 0.41
HTR3A P46098 1/20 0.41
HTR3D Q70Z44 1/20 0.41
HTR3C Q8WXA8 1/20 0.41
GRM4 Q14833 1/20 0.40
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
BRAF P15056 2/20 0.39
KIT P10721 1/20 0.39
FLT3 P36888 1/20 0.39
NOTUM Q6P988 2/20 0.39
TRPV1 Q8NER1 1/20 0.39

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
SCHEMBL10794853 0.74 IDO1 (0.44) KDRPDK1CA1CA2CA7
Ethylene SCHEMBL28056951 0.74 LMNA (0.40) KDRPDK1CA1CA2CA7
SCHEMBL14303602 0.73 NOTUM (0.49) KDRPDK1HTR3EHTR3BHTR3A
SCHEMBL11503126 0.71 KDR (0.50) KDRPDK1CA1CA2CA7
SCHEMBL24766925 0.70 NPFFR2 (0.50) KDRPDK1CA1CA2CA7
SCHEMBL10656533 0.69 KDR (0.56) KDRPDK1CA1CA2CA7
SCHEMBL11473055 0.69 LMNA (0.47) KDRGRM4BRAFNOTUMHTT
SCHEMBL25745990 0.69 NOTUM (0.43) KDRHTR3EHTR3BHTR3AHTR3D
SCHEMBL27624474 0.69 HTR3E (0.41) KDRPDK1CA1CA2CA7
SCHEMBL11743617 0.68 KDR (0.61) KDRPDK1CA1CA2CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230391734-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF NEUROPORE THERAPIES, INC. (US) 2023-12-07 US disclosed
US-11708338-B2 Substituted phenyl sulfonyl phenyl triazole thiones and uses thereof NEUROPORE THERAPIES, INC. (US) 2023-07-25 US disclosed
US-20210300881-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF NEUROPORE THERAPIES, INC. (US) 2021-09-30 US disclosed
US-20210290597-A1 METHOD OF TREATING A CONDITION ASSOCIATED WITH NEURODEGENERATION USING INHIBITORS OF OAT3 NEUROPORE THERAPIES, INC. (US) 2021-09-23 US disclosed
US-11008294-B2 Substituted phenyl sulfonyl phenyl triazole thiones and uses thereof NEUROPORE THERAPIES, INC. (US) 2021-05-18 US disclosed
EP-3810133-A1 METHOD OF TREATING A CONDITION ASSOCIATED WITH NEURODEGENERATION USING INHIBITORS OF OAT3 Neuropore Therapies, Inc. (US) 2021-04-28 EP disclosed
EP-3703675-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF Neuropore Therapies, Inc. (US) 2020-09-09 EP disclosed
US-20200123116-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF NEUROPORE THERAPIES, INC. (US) 2020-04-23 US disclosed
US-20190292158-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF NEUROPORE THERAPIES, INC. (US) 2019-09-26 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 (7 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-20210300881-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF TPMT, ABCB1, DPP8 KDR 3512/4885PDK1 580/4885CA1 4486/4885
US-11008294-B2 Substituted phenyl sulfonyl phenyl triazole thiones and uses thereof TPMT, ABCB1, DPP8 KDR 3512/4885PDK1 580/4885CA1 4486/4885
US-20210290597-A1 METHOD OF TREATING A CONDITION ASSOCIATED WITH NEURODEGENERATION USING INHIBITORS OF OAT3 OAT, CLN6, SLC2A3 KDR 4532/4885PDK1 3401/4885CA1 1527/4885
US-20190292158-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF TPMT, ABCB1, DPP8 KDR 3512/4885PDK1 580/4885CA1 4486/4885
US-11708338-B2 Substituted phenyl sulfonyl phenyl triazole thiones and uses thereof TPMT, ABCB1, DPP8 KDR 3512/4885PDK1 580/4885CA1 4486/4885
US-20230391734-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF TPMT, ABCB1, DPP8 KDR 3512/4885PDK1 580/4885CA1 4486/4885
US-20200123116-A1 SUBSTITUTED PHENYL SULFONYL PHENYL TRIAZOLE THIONES AND USES THEREOF TPMT, ABCB1, DPP8 KDR 3512/4885PDK1 580/4885CA1 4486/4885

“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.