SCHEMBL6493841

SCHEMBL6493841

CN(Cc1ccccc1N1CCC(N)CC1)S(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.46
USP2 O75604 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.38
CYP1A2 P05177 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC6A2 P23975 1/20 0.36
JAK2 O60674 3/20 0.36
JAK3 P52333 3/20 0.36
PTK2 Q05397 3/20 0.36
KDM1A O60341 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NCF1 P14598 1/20 0.35
NPY5R Q15761 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MC4R P32245 1/20 0.35

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
SCHEMBL14355777 0.82 NCF1 (0.50) USP2KMT2AJAK2JAK3PTK2
SCHEMBL14355986 0.81 HTR1A (0.49) KDM4ECYP1A2HSD17B10SLC6A2
SCHEMBL6221717 0.79 F10 (0.48) F10USP2MEN1GAAKMT2A
SCHEMBL6220925 0.76 MC4R (0.41) F10USP2MEN1GAAKMT2A
SCHEMBL5343864 0.73 GPR119 (0.43) GAASMN1; SMN2ALDH1A1MC4R
SCHEMBL5073799 0.72 MEN1 (0.41) USP2MEN1GAAKMT2AKDM4E
SCHEMBL5073795 0.70 MEN1 (0.42) USP2MEN1GAAKMT2AKDM4E
SCHEMBL2634661 0.69 KDM4E (0.48) USP2GAAKDM4ECYP1A2HSD17B10
SCHEMBL2635127 0.69 KDM4E (0.48) USP2KDM4ECYP1A2HSD17B10JAK2
SCHEMBL13733091 0.69 MEN1 (0.56) USP2MEN1GAAKMT2AKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212054-A1 Substituted amino methyl factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-11-13 US claimed
US-6949550-B2 Substituted amino methyl factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2005-09-27 US disclosed
US-20030212054-A1 Substituted amino methyl factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-11-13 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-20030212054-A1 Substituted amino methyl factor Xa inhibitors F11, F10, F9 F10 2/4885USP2 3850/4885MEN1 1315/4885

“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.