SCHEMBL5651334

SCHEMBL5651334

Cc1cccc2[nH]c(-c3ccc(C(=O)NN4CCCCC4)cc3)nc12

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPSE Q9Y251 3/20 0.57
KDM4E B2RXH2 2/20 0.56
NPC1 O15118 2/20 0.56
ALDH1A1 P00352 2/20 0.56
TP53 P04637 2/20 0.56
HPGD P15428 2/20 0.56
RAB9A P51151 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
HSD17B10 Q99714 2/20 0.56
MGAM O43451 7/20 0.54
GAA P10253 7/20 0.54
SI P14410 7/20 0.54
MGAM2 Q2M2H8 7/20 0.54
MAPT P10636 1/20 0.51
PARP1 P09874 5/20 0.49
DHODH Q02127 1/20 0.49
HTT P42858 1/20 0.47
PARP2 Q9UGN5 1/20 0.46
PTGDR2 Q9Y5Y4 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
SCHEMBL5650808 0.86 MGAM (0.48) HPSEKDM4ENPC1ALDH1A1TP53
SCHEMBL5651271 0.84 MGAM (0.50) HPSEKDM4ENPC1ALDH1A1TP53
SCHEMBL5652484 0.84 HPSE (0.48) HPSEKDM4ENPC1ALDH1A1TP53
SCHEMBL5650016 0.82 MGAM (0.48) HPSEKDM4ENPC1TP53RAB9A
SCHEMBL5651444 0.81 PRMT5 (0.59) HPSEHTT
SCHEMBL6585826 0.81 HPSE (0.67) HPSEKDM4ENPC1ALDH1A1TP53
SCHEMBL5652928 0.80 HPSE (0.53) HPSENPC1RAB9ASMN1; SMN2MGAM
SCHEMBL5651985 0.78 PRSS12 (0.54) HPSEPTGDR2
SCHEMBL5651534 0.78 HTT (0.52) HPSEHTT
SCHEMBL7945641 0.77 MGAM (0.69) HPSEKDM4ENPC1ALDH1A1TP53

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 HPSE 3728/4885KDM4E 1605/4885NPC1 1699/4885

“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.