SCHEMBL17704015

SCHEMBL17704015

CC1(C)c2ccccc2Oc2ccc(-c3ccc4c(c3)c3cc(C#N)ccc3n4-c3ccncc3)cc21

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ABCC9 O60706 7/20 0.34
▸ TNKS2 Q9H2K2 1/20 0.33
▸ PGR P06401 3/20 0.31
▸ CTSD P07339 1/20 0.31
▸ BACE1 P56817 1/20 0.31
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CA P42336 1/20 0.30
▸ ROCK2 O75116 1/20 0.30
▸ ROCK1 Q13464 1/20 0.30
▸ PTGER4 P35408 1/20 0.30
▸ SRPK2 P78362 1/20 0.30
▸ SRPK1 Q96SB4 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
SCHEMBL17704032 0.92 ABCC9 (0.34) ABCC9PGR
SCHEMBL17703994 0.92 PGR (0.35) ABCC9PGRCTSDBACE1PIK3CD
SCHEMBL17704013 0.90 CYP11B2 (0.36) ABCC9BACE1PIK3CD
SCHEMBL17703990 0.89 ABCC9 (0.33) ABCC9TNKS2PGRPIK3CDPIK3CA
SCHEMBL17703995 0.89 CYP11B2 (0.41) ABCC9CTSDBACE1PIK3CDPIK3CA
SCHEMBL17704058 0.89 PIK3CD (0.39) ABCC9PGRPIK3CDPIK3CA
SCHEMBL17704055 0.88 KIF11 (0.35) ABCC9PGRPIK3CDPIK3CA
SCHEMBL17704068 0.87 ABCC9 (0.35) ABCC9TNKS2PGRCTSDBACE1
SCHEMBL17704059 0.87 TNKS2 (0.32) ABCC9TNKS2
SCHEMBL17704011 0.86 ABCC9 (0.34) ABCC9PGRCTSDBACE1

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-9722187-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-08-01 — — US disclosed
US-20160118599-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-04-28 — — 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-20160118599-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, AOX1, CYP1A1 ABCC9 2989/4885TNKS2 3678/4885PGR 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.

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