SCHEMBL5653255

SCHEMBL5653255

CCOc1cc(C(=O)NCCCN(CC)CC)ccc1-c1nc2cc(C(F)(F)F)ccc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.45
HTT P42858 2/20 0.45
HDAC6 Q9UBN7 2/20 0.43
HDAC4 P56524 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
NAMPT P43490 1/20 0.42
MCHR1 Q99705 1/20 0.42
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
GAA P10253 2/20 0.41
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40
TSHR P16473 1/20 0.40
METAP2 P50579 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RECQL P46063 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
F9 P00740 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
SCHEMBL5653244 0.94 FLT3 (0.51) FLT3HTTHDAC6HDAC4HDAC2
SCHEMBL5654000 0.93 HTT (0.49) FLT3HTTHDAC6HDAC4HDAC2
SCHEMBL5650115 0.89 FLT3 (0.57) FLT3NAMPTROCK2ROCK1METAP2
SCHEMBL5651756 0.88 FLT3 (0.47) FLT3HTTHDAC6HDAC4HDAC2
SCHEMBL5650988 0.88 FLT3 (0.47) FLT3HTTHDAC6HDAC4HDAC2
SCHEMBL5649510 0.87 FLT3 (0.46) FLT3HTTHDAC6PRMT5WDR77
SCHEMBL5647616 0.87 HTT (0.43) HTTHDAC6HDAC4HDAC2HDAC8
SCHEMBL5653988 0.86 FLT3 (0.51) FLT3HTTHDAC6HDAC4HDAC2
SCHEMBL5653267 0.85 HDAC6 (0.53) FLT3HDAC6HDAC4HDAC2HDAC8
SCHEMBL5647607 0.85 HTT (0.43) HTTHDAC6HDAC4HDAC2HDAC8

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 1968/4885HTT 4354/4885HDAC6 537/4885

“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.