SCHEMBL26042486

SCHEMBL26042486

CCOC(=O)c1nc(O)c2scc(-c3ccccn3)c2n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CDC7 O00311 6/20 0.40
DBF4 Q9UBU7 6/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
KRAS P01116 1/20 0.40
HSD17B10 Q99714 3/20 0.40
KDM4E B2RXH2 2/20 0.40
CASP1 P29466 1/20 0.40
POLB P06746 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CA1 P00915 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
SCHEMBL29720631 1.00 LMNA (0.48) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL24128144 0.85 ADORA3 (0.35) LMNANPC1RAB9AKRASKDM4E
SCHEMBL26038568 0.83 BRD4 (0.43) LMNANPC1RAB9AMEN1KMT2A
SCHEMBL29720521 0.82 CSNK2A1 (0.43) LMNANPC1RAB9AKMT2AKRAS
SCHEMBL26042492 0.82 CSNK2A1 (0.43) LMNANPC1RAB9AKMT2AKRAS
SCHEMBL24128068 0.81 IKBKB (0.41) LMNANPC1RAB9AKRASSMN1; SMN2
SCHEMBL29720667 0.80 ADORA3 (0.42) RAB9AMEN1KMT2AHSD17B10KDM4E
SCHEMBL29720656 0.80 ADORA3 (0.42) RAB9AMEN1KMT2AHSD17B10KDM4E
SCHEMBL24128110 0.80 ADORA3 (0.42) RAB9AMEN1KMT2AHSD17B10KDM4E
SCHEMBL24128109 0.79 TGFBR1 (0.43) LMNANPC1RAB9AKMT2AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227466-A1 SUBSTITUTED THIENOPYRIMIDINES THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE SHY THERAPEUTICS, LLC 2023-07-20 US disclosed
US-20230227466-A1 SUBSTITUTED THIENOPYRIMIDINES THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE SHY THERAPEUTICS, LLC 2023-07-20 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-20230227466-A1 SUBSTITUTED THIENOPYRIMIDINES THAT INTERACT WITH THE RAS SUPERFAMILY FOR THE TREATMENT OF CANCERS, INFLAMMATORY DISEASES, RASOPATHIES, AND FIBROTIC DISEASE KRAS, G3BP1, NRAS LMNA 3970/4885NPC1 4140/4885RAB9A 82/4885

“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.