SCHEMBL5653028

SCHEMBL5653028

CCN(CC)CCCNC(=O)c1ccc(-c2nc3cc(C(F)(F)F)cc(Cl)c3[nH]2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.43
HTT P42858 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
METAP2 P50579 1/20 0.42
HDAC4 P56524 2/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC8 Q9BY41 2/20 0.42
HDAC6 Q9UBN7 2/20 0.42
TACR2 P21452 1/20 0.41
TACR1 P25103 1/20 0.41
GAA P10253 2/20 0.41
MCHR1 Q99705 1/20 0.40
MAPT P10636 1/20 0.40
FLT3 P36888 1/20 0.39
USP7 Q93009 2/20 0.38
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL5650796 0.92 HTT (0.45) TP53HTTSMN1; SMN2METAP2HDAC4
SCHEMBL5651724 0.90 HTT (0.47) TP53HTTSMN1; SMN2METAP2HDAC4
SCHEMBL5647616 0.89 HTT (0.43) TP53HTTSMN1; SMN2METAP2HDAC4
SCHEMBL5647982 0.88 HDAC6 (0.50) TP53HTTSMN1; SMN2HDAC4HDAC2
SCHEMBL5650773 0.88 FLT3 (0.49) TP53METAP2TACR2TACR1MAPT
SCHEMBL5653019 0.87 METAP2 (0.46) TP53HTTSMN1; SMN2METAP2HDAC4
SCHEMBL5648813 0.83 PRSS12 (0.49) TP53HTTSMN1; SMN2HDAC6GAA
SCHEMBL5652123 0.82 TP53 (0.46) TP53HTTSMN1; SMN2HDAC6GAA
SCHEMBL5652128 0.82 TP53 (0.46) TP53HTTSMN1; SMN2HDAC6GAA
SCHEMBL5651383 0.81 FLT3 (0.48) METAP2TACR2TACR1FLT3

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 TP53 4051/4885HTT 4354/4885SMN1; SMN2 1510/4885

“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.