SCHEMBL24449093

SCHEMBL24449093

CN1CCN(Cc2ccc(NC(=O)Nc3cc(C#Cc4ccc(N)nc4)n(C)n3)cc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 8/20 0.75
ABL2 P42684 6/20 0.75
KIT P10721 4/20 0.51
MAPK14 Q16539 4/20 0.50
FLT3 P36888 2/20 0.47
CSF1R P07333 1/20 0.47
MTOR P42345 3/20 0.42
PIK3CA P42336 2/20 0.42
CDK2 P24941 1/20 0.41
CDK6 Q00534 1/20 0.41
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL19317676 0.86 ABL1 (1.00) ABL1ABL2KITMAPK14CDK2
SCHEMBL19317711 0.82 ABL1 (0.53) ABL1ABL2KITMAPK14FLT3
SCHEMBL19317706 0.80 ABL1 (0.76) ABL1ABL2MAPK14FLT3CSF1R
SCHEMBL19317694 0.80 ABL1 (0.89) ABL1ABL2KITMAPK14FLT3
SCHEMBL19317696 0.80 ABL1 (0.89) ABL1ABL2KITMAPK14CDK2
SCHEMBL19317697 0.78 ABL1 (0.86) ABL1ABL2KITMAPK14
SCHEMBL19317699 0.78 ABL1 (0.86) ABL1ABL2KITMAPK14CDK2
SCHEMBL19317690 0.76 ABL1 (0.83) ABL1ABL2KITMAPK14CDK2
SCHEMBL19317688 0.75 ABL1 (0.81) ABL1ABL2KITMAPK14
SCHEMBL19317692 0.75 ABL1 (0.64) ABL1ABL2KITMAPK14FLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220160705-A1 METHODS FOR CONTROLLING PROSTAGLANDIN-MEDIATED BIOLOGICAL PROCESSES CORNELL UNIVERSITY 2022-05-26 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-20220160705-A1 METHODS FOR CONTROLLING PROSTAGLANDIN-MEDIATED BIOLOGICAL PROCESSES PTGES, PTGS1, PTGES2 ABL1 4516/4885ABL2 2755/4885KIT 2155/4885

“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.