SCHEMBL30901337

SCHEMBL30901337

CCOC(=O)c1ccc2c(c1)/C(=C(\CC)OCC)C(=O)N2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.47
TDO2 P48775 1/20 0.47
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
AKR1B1 P15121 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ALDH1A1 P00352 4/20 0.42
MAPK1 P28482 3/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 2/20 0.42
POLB P06746 1/20 0.42
CCNB2 O95067 1/20 0.42
CDK1 P06493 1/20 0.42
CCNB1 P14635 1/20 0.42
MDH2 P40926 1/20 0.42

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
SCHEMBL27215450 0.90 IDO1 (0.47) IDO1TDO2ALDH1A1POLBCDK1
SCHEMBL27214660 0.90 IDO1 (0.47) IDO1TDO2ALDH1A1POLBCDK1
SCHEMBL9113250 0.82 CA12 (0.50) IDO1TDO2CA12CA1CA2
Hydrochloric Acid SCHEMBL11430193 0.81 CA12 (0.49) IDO1TDO2CA12CA1CA2
SCHEMBL27214668 0.81 IDO1 (0.40) IDO1TDO2RXFP1POLBPDPK1
SCHEMBL27231252 0.81 IDO1 (0.40) IDO1TDO2RXFP1POLBPDPK1
SCHEMBL3152862 0.77 SMN1; SMN2 (0.49) IDO1TDO2RXFP1ALDH1A1MAPK1
SCHEMBL3152850 0.77 SMN1; SMN2 (0.49) IDO1TDO2RXFP1ALDH1A1MAPK1
SCHEMBL7013721 0.77 IDO1 (0.46) IDO1TDO2RXFP1ALDH1A1HSD17B10
SCHEMBL2241739 0.75 CA12 (0.54) CA12CA1CA2CA7CA9

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-20240150368-A1 ULK INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2024-05-09 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-20240150368-A1 ULK INHIBITORS AND METHODS OF USE THEREOF ULK1, ULK2, ULK3 IDO1 3772/4885TDO2 4251/4885CA12 4743/4885

“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.