SCHEMBL19909435

SCHEMBL19909435

Cc1cc(-c2cc(-n3c4cc(-c5ccccc5C)ccc4c4ccc(-c5ccccc5C)cc43)c(C#N)c(-n3c4cc(-c5ccccc5C)ccc4c4ccc(-c5ccccc5C)cc43)c2)cc(C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.38
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 4/20 0.37
HPGD P15428 3/20 0.37
HSD17B10 Q99714 1/20 0.37
TRPA1 O75762 1/20 0.37
ABL1 P00519 1/20 0.35
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
METAP2 P50579 1/20 0.34
PIP4K2A P48426 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
LMNA P02545 2/20 0.34
RXFP1 Q9HBX9 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL19909433 0.97 AR (0.36) ARKDM4EALDH1A1HPGDHSD17B10
SCHEMBL22563690 0.91 AR (0.37) ARKDM4EALDH1A1HPGDHSD17B10
SCHEMBL19919667 0.90 TRPA1 (0.42) KDM4EALDH1A1HPGDHSD17B10TRPA1
SCHEMBL21279078 0.88 ALDH1A1 (0.35) ARKDM4EALDH1A1HPGDHSD17B10
SCHEMBL22563691 0.88 AR (0.35) ARKDM4EALDH1A1HPGDHSD17B10
SCHEMBL19909418 0.87 ABL1 (0.39) ARALDH1A1HPGDHSD17B10TRPA1
SCHEMBL19909223 0.87 ABL1 (0.35) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL19909221 0.87 PDE9A (0.34) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL21414215 0.87 AR (0.39) ARKDM4EALDH1A1TRPA1ABL1
SCHEMBL19908985 0.87 ALDH1A1 (0.42) KDM4EALDH1A1HPGDHSD17B10METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287451-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 EP 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 AR 4245/4885KDM4E 4526/4885ALDH1A1 297/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 AR 4444/4885KDM4E 3845/4885ALDH1A1 882/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 AR 4245/4885KDM4E 4526/4885ALDH1A1 297/4885

“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.