SCHEMBL18878386

SCHEMBL18878386

Cc1cc(C(=O)C(C)C)c(C)c(C)c1CC(C)C

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FFAR1 O14842 1/20 0.32
CXCR5 P32302 5/20 0.32
BCL2 P10415 1/20 0.32
MCL1 Q07820 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
PGK1 P00558 1/20 0.32
PGK2 P07205 1/20 0.32
KDM4E B2RXH2 1/20 0.31
DBH P09172 1/20 0.31
GAA P10253 1/20 0.31
RECQL P46063 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL15698070 0.79 FFAR1 (0.38) POLBFFAR1BCL2MCL1KDM4E
SCHEMBL18878381 0.78 KDM4E (0.40) POLBL3MBTL1FFAR1BCL2MCL1
SCHEMBL18878382 0.76 NPSR1 (0.37) POLBL3MBTL1FFAR1ALOX15ALOX12
SCHEMBL18878385 0.73 GABRA1 (0.38) POLBL3MBTL1ALDH1A1
SCHEMBL18878378 0.71 LMNA (0.39) POLBL3MBTL1FFAR1GAAALDH1A1
SCHEMBL9875150 0.70 AKR1C2 (0.38) POLBL3MBTL1KDM4EGAAALDH1A1
SCHEMBL18878383 0.70 GABRA1 (0.47)
SCHEMBL26177667 0.70 POLB (0.46) POLBFFAR1BCL2MCL1KDM4E
SCHEMBL3350799 0.69 POLB (0.47) POLBL3MBTL1CXCR5ALDH1A1
SCHEMBL18878377 0.68 FFAR1 (0.40) POLBL3MBTL1FFAR1KDM4EDBH

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
US-9951074-B2 Dihydropteridinone derivatives and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-04-24 US disclosed
US-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 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-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF BRDT, BRD4, BRD3 POLB 183/4885L3MBTL1 3597/4885FFAR1 4194/4885

“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.