SCHEMBL5652759

SCHEMBL5652759

COc1cc(C(=O)NCCCN)ccc1-c1nc2cc3ccccc3cc2[nH]1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 11/20 0.55
ROCK2 O75116 2/20 0.46
ROCK1 Q13464 2/20 0.46
HDAC6 Q9UBN7 1/20 0.46
BRD4 O60885 1/20 0.45
TSHR P16473 1/20 0.45
MAPK10 P53779 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL5652589 0.91 FLT3 (0.49) FLT3BRD4SMN1; SMN2
SCHEMBL5651447 0.89 FLT3 (0.62) FLT3ROCK2ROCK1HDAC6BRD4
SCHEMBL5651430 0.89 FLT3 (0.69) FLT3HDAC6BRD4
SCHEMBL5649310 0.89 FLT3 (0.53) FLT3ROCK2ROCK1
SCHEMBL5651518 0.87 FLT3 (0.53) FLT3
SCHEMBL5653023 0.87 PRMT5 (0.50) ROCK2ROCK1HDAC6
SCHEMBL5650264 0.86 FLT3 (0.54) FLT3HDAC6
SCHEMBL5651423 0.86 FLT3 (0.51) FLT3ROCK2ROCK1
SCHEMBL5651204 0.86 FLT3 (0.51) FLT3ROCK2ROCK1
SCHEMBL5651413 0.86 FLT3 (0.53) FLT3ROCK2ROCK1

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-7220769-B2 Azolylbenzamides and analogues and their use for treating osteoporosis NIKEM RESEARCH S.R.L. (IT) 2007-05-22 US disclosed
US-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis 3-V BIOSCIENCES, INC. 2005-02-17 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-20050038095-A1 Azolylbenzamides and analogues and their use for treating osteoporosis NR0B2, NR0B1, NCOR1 FLT3 1968/4885ROCK2 1536/4885ROCK1 1602/4885

“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.