SCHEMBL6154237

SCHEMBL6154237

NC(=O)c1ccc(N[C@H]2CC[C@H](O)CC2)cc1F

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.51
HSP90AA1 P07900 1/20 0.45
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
DGAT1 O75907 1/20 0.44
MAPK8 P45983 1/20 0.44
MAPK9 P45984 1/20 0.44
PARP10 Q53GL7 2/20 0.42
PARP15 Q460N3 1/20 0.42
KIT P10721 1/20 0.40
FLT3 P36888 1/20 0.40

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
SCHEMBL6154234 1.00 ROCK2 (0.51) ROCK2HSP90AA1PTGS1PTGS2DGAT1
SCHEMBL6154056 0.89 ROCK2 (0.66) ROCK2PTGS1PTGS2DGAT1PARP10
SCHEMBL6153721 0.89 ROCK2 (0.66) ROCK2PTGS1PTGS2DGAT1PARP10
SCHEMBL6153723 0.89 ROCK2 (0.66) ROCK2PTGS1PTGS2DGAT1PARP10
SCHEMBL6156769 0.84 ROCK2 (0.47) ROCK2PTGS1PTGS2DGAT1PARP10
SCHEMBL6154351 0.84 PTGS1 (0.52) ROCK2HSP90AA1PTGS1PTGS2DGAT1
SCHEMBL6154356 0.84 PTGS1 (0.52) ROCK2HSP90AA1PTGS1PTGS2DGAT1
Cyanate SCHEMBL27865182 0.82 PTGS1 (0.50) ROCK2PTGS1PTGS2DGAT1PARP10
SCHEMBL6154534 0.82 ACKR3 (0.48) ROCK2PTGS1PTGS2FLT3
SCHEMBL4580326 0.78 HSP90AA1 (0.55) ROCK2HSP90AA1

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-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 EP 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-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 ROCK2 2/4885HSP90AA1 1686/4885PTGS1 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.