SCHEMBL18239294

SCHEMBL18239294

C[C@H](c1ccccc1)C1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
IDO1 P14902 2/20 0.37
ALDH1A1 P00352 3/20 0.37
GLA P06280 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CSF1R P07333 1/20 0.36
CYP2D6 P10635 1/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
HPGD P15428 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
ATM Q13315 2/20 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
SCHEMBL20385344 1.00 GAA (0.39) GAAL3MBTL1IDO1ALDH1A1GLA
SCHEMBL28046490 0.85 IDO1 (0.48) GAAL3MBTL1IDO1ALDH1A1CYP2D6
SCHEMBL10405701 0.85 IDO1 (0.48) GAAL3MBTL1IDO1ALDH1A1CYP2D6
SCHEMBL22863464 0.82 GAA (0.38) GAAL3MBTL1IDO1ALDH1A1GLA
SCHEMBL22863229 0.82 GAA (0.38) GAAL3MBTL1IDO1ALDH1A1GLA
SCHEMBL22863305 0.82 GAA (0.38) GAAL3MBTL1IDO1ALDH1A1GLA
SCHEMBL29054036 0.81 GAA (0.52) GAAL3MBTL1IDO1ALDH1A1CYP2D6
SCHEMBL7823538 0.81 GAA (0.57) GAAL3MBTL1IDO1ALDH1A1MCOLN3
SCHEMBL21949437 0.81 SLC6A2 (0.36) GAAALDH1A1CSF1RCYP3A4
SCHEMBL18239303 0.81 KDM4E (0.39) IDO1ALDH1A1CYP2D6TSHRCYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3294739-B1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS BRISTOL MYERS SQUIBB CO (US) 2019-07-31 EP disclosed
US-9725449-B2 Tricyclic compounds as anticancer agents BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-08 US disclosed
US-20160333013-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS BRISTOL-MYERS SQUIBB COMPANY 2016-11-17 US disclosed
WO-2016183118-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2016-11-17 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-20160333013-A1 TRICYCLIC COMPOUNDS AS ANTICANCER AGENTS MCL1, TP53, TOP2A GAA 218/4885L3MBTL1 2418/4885IDO1 1325/4885

“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.