SCHEMBL7123330

SCHEMBL7123330

CN(C(=O)[C@@H]1CCCN1)C1CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 1/20 0.50
GLI1 P08151 2/20 0.46
NOS2 P35228 2/20 0.39
NOS3 P29474 1/20 0.39
NOS1 P29475 1/20 0.39
PRCP P42785 1/20 0.38
DPP4 P27487 6/20 0.38
DPP8 Q6V1X1 4/20 0.37
DPP9 Q86TI2 4/20 0.37
DPP7 Q9UHL4 2/20 0.36
FAP Q12884 1/20 0.36
CCR4 P51679 1/20 0.36

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
SCHEMBL7122076 1.00 SCN4A (0.50) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL3332522 0.96 SCN4A (0.50) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL6861704 0.93 SCN4A (0.48) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL13902906 0.91 SCN4A (0.47) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL31717193 0.85 SCN4A (0.43) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL31717480 0.85 SCN4A (0.43) SCN4AGLI1NOS2NOS3NOS1
Hydrochloric Acid SCHEMBL31717753 0.84 SCN4A (0.42) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL894617 0.82 GLI1 (0.66) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL255493 0.82 GLI1 (0.66) SCN4AGLI1NOS2NOS3NOS1
SCHEMBL490079 0.82 GLI1 (0.66) SCN4AGLI1NOS2NOS3NOS1

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-6599902-B2 For treating or preventing a protein kinase related disorder SUGEN, INC. 2003-07-29 US disclosed
US-20030125370-A1 5-ARALKYSUFONYL-3-(PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS SUGEN, INC. 2003-07-03 US disclosed
WO-2002096361-A2 5-ARALKYLSULFONYL-3- (PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS SUGEN, INC. (US) 2002-12-05 WO 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-20030125370-A1 5-ARALKYSUFONYL-3-(PYRROL-2-YLMETHYLIDENE)-2-INDOLINONE DERIVATIVES AS KINASE INHIBITORS DMPK, ADK, MAP3K20 SCN4A 4308/4885GLI1 1250/4885NOS2 3333/4885

“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.