SCHEMBL7137684

SCHEMBL7137684

Cn1cnc(S(=O)(=O)C(N)C2CCNCC2)c1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.37
TSHR P16473 2/20 0.37
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 2/20 0.34
PKM P14618 1/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC6A9 P48067 2/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL7136247 0.73 KDM4E (0.35) KDM4ELMNAPOLBSLC6A9TP53
SCHEMBL12020967 0.69 LMNA (0.44) TSHRKMT2ALMNAPKMMEN1
SCHEMBL14837754 0.68 LMNA (0.53) TSHRLMNAPKMPOLBSLC6A9
Hydrochloric Acid SCHEMBL1181300 0.67 LMNA (0.52) TSHRLMNAPKMPOLBSLC6A9
Hydrochloric Acid SCHEMBL989631 0.67 LMNA (0.38) TSHRKMT2AKDM4ELMNAPKM
SCHEMBL17922960 0.67 KDM4E (0.35) TSHRKMT2AKDM4ELMNAPKM
SCHEMBL20368329 0.66 LMNA (0.42) TSHRKMT2ALMNAPKMMEN1
SCHEMBL304175 0.65 LMNA (0.46) TSHRKMT2ALMNAPKMMEN1
SCHEMBL1517261 0.65 LMNA (0.37) DPP4TSHRLMNA
SCHEMBL50543 0.65 LMNA (0.46) TSHRKMT2ALMNAPKMMEN1

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-6506901-B2 1-(9H-Carbazol-4-yloxy)-3-((1-(7-trifluoromethyl-quinolin-4-yl) -piperidin-4-lmethyl)-amino)-propan-2-ol, for example; treating diabetes, urinary continence, atherosclerosis, gastrointestinal disorders, glaucoma WYETH 2003-01-14 US disclosed
US-20020037907-A1 Substituted 2- (S) -hydroxy-3- (piperidin-4-yl-methylamino) -propyl ethers and substituted 2-aryl-2- (R) - hydroxy-1- (piperidin-4-yl-methyl) -ethylamine beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-28 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-20020037907-A1 Substituted 2- (S) -hydroxy-3- (piperidin-4-yl-methylamino) -propyl ethers and substituted 2-aryl-2- (R) - hydroxy-1- (piperidin-4-yl-methyl) -ethylamine beta-3 adrenergic receptor agonists GPR119, ADRB1, ADRB2 DPP4 404/4885TSHR 450/4885KMT2A 1959/4885

“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.