SCHEMBL6154056

SCHEMBL6154056

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

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 2/20 0.66
ROCK1 Q13464 1/20 0.51
KIT P10721 4/20 0.45
FLT3 P36888 4/20 0.45
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
DGAT1 O75907 1/20 0.44
PARP10 Q53GL7 2/20 0.42
PARP15 Q460N3 1/20 0.42
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
SYK P43405 3/20 0.39
KCNQ3 O43525 1/20 0.39
KCNQ2 O43526 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MELK Q14680 2/20 0.38
KDM1A O60341 1/20 0.38
KCNH2 Q12809 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
SCHEMBL6153721 1.00 ROCK2 (0.66) ROCK2ROCK1KITFLT3PTGS1
SCHEMBL6153723 1.00 ROCK2 (0.66) ROCK2ROCK1KITFLT3PTGS1
SCHEMBL6154234 0.89 ROCK2 (0.51) ROCK2KITFLT3PTGS1PTGS2
SCHEMBL6154237 0.89 ROCK2 (0.51) ROCK2KITFLT3PTGS1PTGS2
SCHEMBL6156769 0.84 ROCK2 (0.47) ROCK2PTGS1PTGS2DGAT1PARP10
SCHEMBL6154351 0.84 PTGS1 (0.52) ROCK2ROCK1PTGS1PTGS2DGAT1
SCHEMBL6154356 0.84 PTGS1 (0.52) ROCK2ROCK1PTGS1PTGS2DGAT1
Cyanate SCHEMBL27865182 0.82 PTGS1 (0.50) ROCK2PTGS1PTGS2DGAT1PARP10
SCHEMBL6154534 0.82 ACKR3 (0.48) ROCK2FLT3PTGS1PTGS2JAK2
SCHEMBL25039539 0.81 KDM1A (0.53) ROCK2PTGS1PTGS2KCNQ3KCNQ2

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 2/4885ROCK1 1/4885KIT 775/4885

“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.