SCHEMBL6038391

SCHEMBL6038391

C1CCCCCCCCCCCCCCCCCCCN=C2CCCCCN2CCCCCCCCCCCCCCCCCCC1

nearest known ligand 0.91

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
INMT O95050 4/20 0.91
USP2 O75604 2/20 0.91
NOS3 P29474 5/20 0.41
NOS1 P29475 5/20 0.41
NOS2 P35228 5/20 0.41
ACHE P22303 5/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TSHR P16473 1/20 0.34
LMNA P02545 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL496207 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL219036 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL6859113 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL5475300 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL2956216 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL3270217 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL2956214 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL2742282 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL20718625 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2
SCHEMBL2952223 1.00 INMT (0.91) INMTUSP2NOS3NOS1NOS2

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
CN-115397828-A Preparation of MCL-1 inhibiting compounds by methylation in the presence of water 美国安进公司 2022-11-25 CN disclosed
US-20060004019-A1 Steroid sparing agents and methods of using same BIOGEN IDEC INTERNATIONAL HOLDING LTD. (BM) 2006-01-05 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-20060004019-A1 Steroid sparing agents and methods of using same IL5, FCER2, CD40 INMT 910/4885USP2 3662/4885NOS3 2720/4885

“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.