SCHEMBL20150617

SCHEMBL20150617

Cc1ccc2c(c1)Oc1cc(C)ccc1[Si]2(c1ccccc1)c1cccc(N(c2ccc(-c3cccc4ccccc34)cc2)c2cccc3ccccc23)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
ENPP3 O14638 1/20 0.32
ENPP1 P22413 1/20 0.32
MCL1 Q07820 1/20 0.30
ACMSD Q8TDX5 1/20 0.30
SIGMAR1 Q99720 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
SCHEMBL20150606 0.89 MCL1 (0.33) ENPP3ENPP1MCL1ACMSDSIGMAR1
SCHEMBL20150604 0.88 MAOB (0.35) MAOAMAOBENPP3ENPP1MCL1
SCHEMBL20150622 0.87 MAOA (0.33) MAOAMAOBENPP3ENPP1MCL1
SCHEMBL20150614 0.85 ENPP3 (0.32) MAOAMAOBENPP3ENPP1
SCHEMBL20150608 0.84 PPARG (0.33) MCL1ACMSD
SCHEMBL20150598 0.83 PPARG (0.34) ENPP3ENPP1MCL1ACMSD
SCHEMBL20150625 0.83 CA12 (0.35) MCL1ACMSD
SCHEMBL20150623 0.82 CA12 (0.34) ENPP3ENPP1MCL1ACMSD
SCHEMBL20150631 0.82
SCHEMBL20150610 0.81 CA12 (0.36) ENPP3ENPP1MCL1ACMSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10550134-B2 Heterocyclic compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-04 US disclosed
US-20180134732-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-17 US disclosed
US-20180134732-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-17 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-10550134-B2 Heterocyclic compound and organic electroluminescence device including the same ODC1, KCNC1, KCNH1 MAOA 371/4885MAOB 581/4885ENPP3 2429/4885
US-20180134732-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME ODC1, KCNC1, KCNH1 MAOA 371/4885MAOB 581/4885ENPP3 2429/4885

“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.