SCHEMBL5650646

SCHEMBL5650646

COc1ccc2nc(-c3ccc(C(=O)NC4CN5CCC4CC5)cc3)[nH]c2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 8/20 0.52
CHEK1 O14757 1/20 0.52
AURKA O14965 1/20 0.52
PRKD3 O94806 1/20 0.52
PRKCG P05129 1/20 0.52
PRKCB P05771 1/20 0.52
PRKCA P17252 1/20 0.52
CCNA2 P20248 1/20 0.52
PRKCH P24723 1/20 0.52
CDK2 P24941 1/20 0.52
PRKCI P41743 1/20 0.52
PRKCE Q02156 1/20 0.52
PRKCQ Q04759 1/20 0.52
PRKCZ Q05513 1/20 0.52
PRKCD Q05655 1/20 0.52
PRKD1 Q15139 1/20 0.52
CHRNA7 P36544 2/20 0.50
HTR3A P46098 2/20 0.50
HTR3E A5X5Y0 1/20 0.48
HTR3B O95264 1/20 0.48

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
SCHEMBL5650654 0.93 CHRNA7 (0.50) CHEK2CHRNA7HTR3AHTR3EHTR3B
SCHEMBL5652972 0.86 CHRNA7 (0.57) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL21017869 0.84 CHRNA7 (0.56) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL6125843 0.83 CHEK2 (0.61) CHEK2TSHRMEN1NPC1ALDH1A1
SCHEMBL5650989 0.83 CHRNA7 (0.57) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL5648770 0.79 CHRNA7 (0.52) CHRNA7HTR3AHTR3EHTR3BHTR3D
SCHEMBL5917910 0.77 CHRNA7 (0.60) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL5650718 0.77 CHEK2 (0.58) CHEK2TSHRMEN1NPC1ALDH1A1
SCHEMBL373704 0.77 CHRNA7 (0.64) CHRNA7HTR3AHTR3EHTR3BALOX15
SCHEMBL5648775 0.77 CHEK2 (0.55) CHEK2TSHRMEN1NPC1ALDH1A1

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 CHEK2 4002/4885CHEK1 4591/4885AURKA 4787/4885

“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.