SCHEMBL5651998

SCHEMBL5651998

COc1cc(C(=O)NCCCN)ccc1-c1nc2c(C)c(C)c(Br)cc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 6/20 0.45
LRRK2 Q5S007 1/20 0.42
SUV39H2 Q9H5I1 1/20 0.40
HPSE Q9Y251 1/20 0.40
BRD4 O60885 3/20 0.40
DHODH Q02127 1/20 0.39
POLB P06746 1/20 0.39
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
PTAFR P25105 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
SCHEMBL5649922 0.91 HPSE (0.46) FLT3HPSEBRD4KMT2A
SCHEMBL5653317 0.90 FLT3 (0.46) FLT3HPSE
SCHEMBL5652617 0.89 FLT3 (0.45) FLT3HPSE
SCHEMBL5651519 0.88 FLT3 (0.45) FLT3DHODH
SCHEMBL5653201 0.88 PRMT5 (0.48) HPSEPOLBLMNAMAPTHTT
SCHEMBL5651989 0.86 FLT3 (0.45) FLT3LRRK2SUV39H2BRD4POLB
SCHEMBL5651713 0.84 CYP2D6 (0.59) LMNAMEN1KMT2A
SCHEMBL5651895 0.84 MAPK8 (0.45) FLT3HPSEDHODH
SCHEMBL5649719 0.84 MGAM (0.48) FLT3LRRK2HPSEBRD4ROCK2
SCHEMBL5651343 0.82 FLT3 (0.46) FLT3LRRK2SUV39H2BRD4ROCK2

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 1968/4885LRRK2 2726/4885SUV39H2 304/4885

“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.