SCHEMBL260600

SCHEMBL260600

CC(C)(C)C(=O)NCCCC=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
ALDH1A1 P00352 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
CA3 P07451 2/20 0.39
CA5A P35218 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
CA12 O43570 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
EPHX1 P07099 1/20 0.37
DRD4 P21917 7/20 0.37
DRD2 P14416 6/20 0.37

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
SCHEMBL6446695 0.94 POLB (0.46) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL7292154 0.92 MEN1 (0.45) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL2845918 0.87 POLB (0.42) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL260275 0.84 POLB (0.38) POLBALDH1A1SMN1; SMN2CA3CA5A
SCHEMBL18622113 0.82 POLB (0.57) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL9355210 0.82 POLB (0.57) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL16316312 0.82 POLB (0.50) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL26161761 0.82 EPHX1 (0.48) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL18536691 0.80 POLB (0.49) POLBALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL10633351 0.80 MEN1 (0.58) POLBALDH1A1SMN1; SMN2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445612-B2 Conjugation reactions BIOCOMPATIBLES UK LIMITED (GB) 2013-05-21 US disclosed
US-8445612-B2 Conjugation reactions BIOCOMPATIBLES UK LIMITED (GB) 2013-05-21 US disclosed
US-20120016082-A1 CONJUGATION REACTIONS BIOCOMPATIBLES UK LIMITED (GB) 2012-01-19 US disclosed
US-8053520-B2 Conjugation reactions BIOCOMPATIBLES UK LIMITED (GB) 2011-11-08 US disclosed
US-20100099678-A1 DIALKYLAMINO ALKYL ESTERS OF PIVAGABINE AS MEDICAMENTS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS CENERX BIOPHARMA (US) 2010-04-22 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 (2 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-20120016082-A1 CONJUGATION REACTIONS PHPT1, GNE, MGMT POLB 284/4885ALDH1A1 1053/4885SMN1; SMN2 3385/4885
US-20100099678-A1 DIALKYLAMINO ALKYL ESTERS OF PIVAGABINE AS MEDICAMENTS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS PMP22, CNR2, COQ8A POLB 1224/4885ALDH1A1 2193/4885SMN1; SMN2 65/4885

“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.