SCHEMBL3798524

SCHEMBL3798524

CC(C)S(=O)(=O)N1CCC(Oc2ccccc2Nc2ncnc3sccc23)C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
PIP4K2A P48426 7/20 0.43
PIP4K2C Q8TBX8 1/20 0.40
EGFR P00533 2/20 0.40
ALK Q9UM73 1/20 0.40
RAB9A P51151 2/20 0.39
TNF P01375 2/20 0.39
NOD1 Q9Y239 2/20 0.39
NPC1 O15118 1/20 0.39
PIP4K2B P78356 1/20 0.39
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL3801046 0.91 EGFR (0.46) KMT2AMEN1PIP4K2APIP4K2CEGFR
SCHEMBL3798859 0.89 PIP4K2A (0.44) KMT2AMEN1PIP4K2APIP4K2CEGFR
SCHEMBL3798518 0.89 PIP4K2A (0.44) KMT2AMEN1PIP4K2APIP4K2CEGFR
SCHEMBL3798525 0.88 KMT2A (0.43) KMT2AMEN1PIP4K2APIP4K2CEGFR
SCHEMBL3797069 0.84 PIP4K2C (0.42) PIP4K2CEGFRRAB9AHTTSMN1; SMN2
SCHEMBL3802210 0.83 MEN1 (0.44) KMT2AMEN1EGFRRAB9ATNF
SCHEMBL3800042 0.82 EGFR (0.47) KMT2AMEN1EGFRRAB9ATNF
SCHEMBL3799620 0.82 MEN1 (0.44) KMT2AMEN1EGFRALKRAB9A
SCHEMBL3795832 0.80 MEN1 (0.43) KMT2AMEN1EGFRRAB9ANPC1
SCHEMBL3797986 0.79 MEN1 (0.54) KMT2AMEN1PIP4K2AEGFRRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-06-10 US claimed
EP-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP claimed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 WO claimed
US-20100247517-A1 USE OF MNK INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE Boehringer Ingelheim Internationational GmbH (DE) 2010-09-30 US disclosed
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-06-10 US disclosed
EP-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP disclosed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 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-20100247517-A1 USE OF MNK INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE NEK9, TTBK1, NEK2 KMT2A 1015/4885MEN1 1746/4885PIP4K2A 453/4885
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DTYMK, CMPK1, PDXK KMT2A 1016/4885MEN1 1106/4885PIP4K2A 84/4885

“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.