SCHEMBL6473441

SCHEMBL6473441

Cc1ccc(NC(=O)Nc2cc(CO)sc2C(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 7/20 0.61
MAPK14 Q16539 10/20 0.53
PKM P14618 1/20 0.46
ATM Q13315 1/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 1/20 0.46
PLA2G1B P04054 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
CXCR2 P25025 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL3217455 0.87 RAF1 (0.80) RAF1MAPK14PKMATMALDH1A1
SCHEMBL3244702 0.79 MAPK14 (0.77) RAF1MAPK14
SCHEMBL14159658 0.78 RAF1 (0.78) RAF1MAPK14PKMATMALDH1A1
SCHEMBL15959532 0.77 RAF1 (0.83) RAF1MAPK14PKMATMALDH1A1
SCHEMBL2926566 0.76 RAF1 (1.00) RAF1MAPK14PKMATMALDH1A1
SCHEMBL14159719 0.75 MAPK14 (0.66) RAF1MAPK14PKMATMALDH1A1
SCHEMBL15298832 0.74 RAF1 (0.75) RAF1MAPK14PKMATMALDH1A1
SCHEMBL1275920 0.71 ALDH1A1 (0.70) ALDH1A1MEN1LMNAMAPTHTT
SCHEMBL16920251 0.70 NPC1 (0.66) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL366747 0.68 SMN1; SMN2 (0.74) ALDH1A1MEN1LMNAMAPTHPGD

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-20050256174-A1 Raf kinase inhibitors BAYER HEALTHCARE LLC 2005-11-17 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-20050256174-A1 Raf kinase inhibitors BRAF, RAF1, ARAF RAF1 2/4885MAPK14 239/4885PKM 1684/4885

“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.