SCHEMBL5652470

SCHEMBL5652470

NCCCNC(=O)c1ccc(-c2nc3cc(C(F)(F)F)ccc3[nH]2)c(Br)c1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 16/20 0.61
HDAC3 O15379 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
F9 P00740 1/20 0.40
ABL1 P00519 1/20 0.40
BCR P11274 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
SCHEMBL5652462 0.93 FLT3 (0.68) FLT3HDAC3HDAC7HDAC10HDAC6
SCHEMBL5650983 0.91 FLT3 (0.63) FLT3F9ABL1BCR
SCHEMBL5651066 0.89 FLT3 (0.61) FLT3F9
SCHEMBL5650988 0.87 FLT3 (0.47) FLT3HDAC3HDAC7HDAC10HDAC6
SCHEMBL5650817 0.86 FLT3 (0.58) FLT3
SCHEMBL5653307 0.86 FLT3 (0.64) FLT3
SCHEMBL5650115 0.85 FLT3 (0.57) FLT3
SCHEMBL5651712 0.85 FLT3 (0.48) FLT3
SCHEMBL5648132 0.84 TSHR (0.52) FLT3
SCHEMBL5649663 0.83 FLT3 (0.61) FLT3

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 1968/4885HDAC3 108/4885HDAC7 248/4885

“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.