SCHEMBL16632024

SCHEMBL16632024

O=S(=O)(c1ccc(Cn2ccnc2)cc1)N1CC2(CCCNC2)C1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.51
CYP19A1 P11511 3/20 0.42
CYP11B1 P15538 2/20 0.41
CYP11B2 P19099 2/20 0.41
CHEK1 O14757 1/20 0.41
CYP2A6 P11509 1/20 0.41
CYP2B6 P20813 1/20 0.41
SIRT6 Q8N6T7 1/20 0.41

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
SCHEMBL16632031 0.82 NAMPT (0.45) NAMPTCYP19A1CYP11B1CYP11B2CYP2A6
SCHEMBL28150000 0.79 MAPT (0.54) NAMPTCYP19A1CYP11B1CYP11B2CYP2A6
SCHEMBL28148758 0.77 CYP1A2 (0.56) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
Hydrochloric Acid SCHEMBL6891778 0.69 CYP19A1 (0.43) CYP19A1CYP11B1
Hydrochloric Acid SCHEMBL6891758 0.69 CYP19A1 (0.43) CYP19A1CYP11B1
SCHEMBL15531850 0.68 NAMPT (1.00) NAMPT
SCHEMBL28140205 0.68 CYP11B1 (0.63) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL1024261 0.67 CYP11B1 (0.84) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
SCHEMBL19742865 0.66 CYP11B1 (0.68) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6
Hydrochloric Acid SCHEMBL1775141 0.65 CYP11B1 (0.81) CYP19A1CYP11B1CYP11B2CYP2A6CYP2B6

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-10696692-B2 Amido-benzyl sulfone and sulfoxide derivates Valo Health, LLC 2020-06-30 US claimed
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES VALO HEALTH, INC. 2015-04-16 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-10696692-B2 Amido-benzyl sulfone and sulfoxide derivates STS, SQOR, SULT1E1 NAMPT 459/4885CYP19A1 2817/4885CYP11B1 579/4885
US-20150104384-A1 AMIDO-BENZYL SULFONE AND SULFOXIDE DERIVATIVES STS, SULT1E1, CBS NAMPT 759/4885CYP19A1 2466/4885CYP11B1 373/4885

“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.