SCHEMBL6218684

SCHEMBL6218684

CSC(=CC(=O)c1ccccc1C)SC

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
HPGD P15428 3/20 0.46
MAPT P10636 1/20 0.46
GPR52 Q9Y2T5 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TYK2 P29597 1/20 0.41
PSMD14 O00487 1/20 0.41
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
HTT P42858 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 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
SCHEMBL29566671 1.00 MEN1 (0.58) MEN1KMT2AHPGDMAPTGPR52
SCHEMBL6139973 0.81 MEN1 (0.58) MEN1KMT2AHPGDMAPTSMN1; SMN2
SCHEMBL8350519 0.80 GPR52 (0.47) HPGDGPR52SMN1; SMN2ALDH1A1LMNA
SCHEMBL6218498 0.79 KMT2A (0.56) MEN1KMT2AHPGDMAPTALDH1A1
SCHEMBL6219515 0.79 MEN1 (0.56) MEN1KMT2AHPGDMAPTGPR52
SCHEMBL24309273 0.78 MEN1 (0.55) MEN1KMT2AHPGDMAPTGPR52
SCHEMBL24309773 0.78 KMT2A (0.55) MEN1KMT2AHPGDMAPTSMN1; SMN2
SCHEMBL11528927 0.77 GPR52 (0.61) HPGDMAPTGPR52SMN1; SMN2ALDH1A1
SCHEMBL11528932 0.77 GPR52 (0.61) HPGDMAPTGPR52SMN1; SMN2ALDH1A1
SCHEMBL3311630 0.77 GPR52 (0.49) KMT2AHPGDMAPTGPR52SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 US disclosed
US-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS, SAN DIEGO 2023-11-23 US disclosed
WO-2022076627-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 WO disclosed
WO-2022076626-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-04-14 WO disclosed
EP-1458717-B1 AROYL PYRIDINONES BAYER HEALTHCARE AG (DE) 2005-09-07 EP disclosed
US-20050070555-A1 Aroyl pyridinones BAYER HEALTHCARE AG 2005-03-31 US disclosed
EP-1458717-A1 AROYL PYRIDINONES Bayer HealthCare AG (DE) 2004-09-22 EP disclosed
WO-2003053967-A1 AROYL PYRIDINONES BAYER HEALTHCARE AG (DE) 2003-07-03 WO disclosed
EP-0263958-B1 4-SUBSTITUTED-2,6-DIPHENYLPYRIDINE DERIVATIVES, USE THEREOF, PRODUCTION OF THE SAME, CHEMICAL INTERMEDIATES THEREIN AND HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-01-22 EP disclosed
US-4849011-A 4-substituted-2,6-diphenylpyridine compounds and herbicide containing the same as an active ingredient SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1989-07-18 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 (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-20230373935-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR CFTR, SCNN1G, SCNN1B MEN1 4649/4885KMT2A 4613/4885HPGD 1609/4885
US-20050070555-A1 Aroyl pyridinones PNPO, NDUFV2, NDUFS6 MEN1 4688/4885KMT2A 3958/4885HPGD 75/4885

“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.