SCHEMBL3768159

SCHEMBL3768159

CC(C)CC(C)N1C(=O)c2ccc3c4c(Br)cc5c6c(ccc(c7c(Br)cc(c2c37)C1=O)c64)C(=O)N(C(C)CC(C)C)C5=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.35
CYP1B1 Q16678 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
STAT3 P40763 1/20 0.31
HIF1A Q16665 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
TLR9 Q9NR96 1/20 0.31
PIN1 Q13526 1/20 0.30
PIN4 Q9Y237 1/20 0.30
MCL1 Q07820 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
SCHEMBL17515105 0.96 TERT (0.38) TERTCYP1B1TDP1STAT3HIF1A
SCHEMBL13010656 0.94 TERT (0.32) TERTCYP1B1TDP1
SCHEMBL3781232 0.89 CYP1B1 (0.37) TERTCYP1B1TDP1STAT3HIF1A
SCHEMBL3723988 0.86 CYP1B1 (0.35) TERTCYP1B1TDP1STAT3HIF1A
SCHEMBL12869446 0.85 TERT (0.36) TERTCYP1B1STAT3HIF1A
SCHEMBL1793691 0.84 CYP1B1 (0.34) TERTCYP1B1TDP1STAT3HIF1A
SCHEMBL10819507 0.84 CYP1B1 (0.34) TERTCYP1B1TDP1STAT3HIF1A
SCHEMBL17514386 0.83 TDP1 (0.37) TERTTDP1KEAP1NFE2L2TLR9
SCHEMBL3773226 0.83 SHMT2 (0.34) TERTCYP1B1TDP1STAT3HIF1A
SCHEMBL13010687 0.83 CYP1B1 (0.33) TERTCYP1B1TDP1PIN1PIN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3183250-B1 PROCESS FOR PREPARING CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL CLAP CO LTD (KR) 2023-10-04 EP disclosed
EP-3183757-B1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM CLAP CO LTD (KR) 2022-05-04 EP disclosed
US-10454037-B2 Organic semiconductor composition comprising a liquid medium BASF SE (DE) 2019-10-22 US disclosed
US-10224485-B2 Process for preparing a crystalline organic semiconductor material BASF SE (DE) 2019-03-05 US disclosed
EP-2240970-B1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2018-03-14 EP disclosed
US-20170250347-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING A LIQUID MEDIUM BASF SE (DE) 2017-08-31 US disclosed
US-20170237005-A1 PROCESS FOR PREPARING A CRYSTALLINE ORGANIC SEMICONDUCTOR MATERIAL BASF SE (DE) 2017-08-17 US disclosed
EP-3183757-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM BASF SE (DE) 2017-06-28 EP disclosed
WO-2016027217-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING LIQUID MEDIUM BASF SE (DE) 2016-02-25 WO disclosed
US-8404844-B2 Perylene semiconductors and methods of preparation and use thereof BASF SE (DE) 2013-03-26 US disclosed
US-8404844-B2 Perylene semiconductors and methods of preparation and use thereof BASF SE (DE) 2013-03-26 US disclosed
US-20100319778-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2010-12-23 US disclosed
WO-2009098252-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2009-08-13 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 (4 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-20170250347-A1 ORGANIC SEMICONDUCTOR COMPOSITION COMPRISING A LIQUID MEDIUM CRY1, NEFM, OR10J3 TERT 1542/4885CYP1B1 4419/4885TDP1 2275/4885
US-20100319778-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF CDYL, PNN, CPNE4 TERT 1226/4885CYP1B1 1024/4885TDP1 1957/4885
US-10454037-B2 Organic semiconductor composition comprising a liquid medium CRY1, NEFM, OR10J3 TERT 1542/4885CYP1B1 4419/4885TDP1 2275/4885
US-10224485-B2 Process for preparing a crystalline organic semiconductor material STOM, SPOP, TTR TERT 2496/4885CYP1B1 3699/4885TDP1 3713/4885

“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.