SCHEMBL44947

SCHEMBL44947

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

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 4/20 0.38
TERT O14746 5/20 0.36
PIN1 Q13526 1/20 0.33
PIN4 Q9Y237 1/20 0.33
STAT3 P40763 1/20 0.32
HIF1A Q16665 1/20 0.32
ALDH1A1 P00352 2/20 0.30
POLB P06746 2/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
PABPC1 P11940 1/20 0.30
KMT2A Q03164 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL2858238 0.97 TERT (0.40) CYP1B1TERTPIN1PIN4STAT3
SCHEMBL3048471 0.96 TERT (0.38) CYP1B1TERTPIN1PIN4STAT3
SCHEMBL13010692 0.94 CYP1B1 (0.34) CYP1B1TERTPIN1PIN4
SCHEMBL17039719 0.92 CYP1B1 (0.33) CYP1B1TERTPIN1PIN4
SCHEMBL3731220 0.92 CYP1B1 (0.35) CYP1B1TERTPIN1PIN4
SCHEMBL23618213 0.90 TERT (0.37) CYP1B1TERTPIN1PIN4STAT3
SCHEMBL17515106 0.90 CYP1B1 (0.33) CYP1B1TERTSTAT3HIF1A
SCHEMBL17515118 0.89 CYP1B1 (0.33) CYP1B1TERTSTAT3HIF1A
SCHEMBL17515107 0.88 TERT (0.35) CYP1B1TERTPIN1PIN4STAT3
SCHEMBL13087258 0.88 TERT (0.52) CYP1B1TERTALDH1A1POLBKDM4E

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 44 patents — showing the first 20. 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
US-20180214827-A1 PERYLENE DIIMIDE BASED MEMBRANE AND METHODS OF USE THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-08-02 US disclosed
EP-2240970-B1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2018-03-14 EP 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
US-9701784-B2 Supramolecular polymers derived from perylene-diimides YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2017-07-11 US disclosed
US-8399670-B2 Selective bromination of perylene diimides and derivatives thereof under mild conditions YEDA RESEARCH AND DEVELOPMENT CO.LTD (IL) 2013-03-19 US disclosed
WO-2012025928-A1 SEPARATION OF NANOPARTICLES YEDA RESEARCH AND DEVELOPMENT CO.LTD (IL) 2012-03-01 WO disclosed
US-20100319778-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2010-12-23 US disclosed
EP-2240970-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2010-10-20 EP disclosed
US-20100261901-A1 SELECTIVE BROMINATION OF PERYLENE DIIMIDES AND DERIVATIVES THEREOF UNDER MILD CONDITIONS YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2010-10-14 US disclosed
EP-2155741-A2 SELECTIVE BROMINATION OF PERYLENE DIIMIDES AND DERIVATIVES THEREOF UNDER MILD CONDITIONS Yeda Research And Development Co. Ltd. (IL) 2010-02-24 EP disclosed
WO-2009118742-A1 DOUBLY REDUCED PERYLENE-DIIMIDES AND SUPRAMOLECULAR POLYMERS DERIVED FROM PERYLENE-DIIMIDES YEDA RESEARCH AND DEVELOPMENT CO. LTD (IL) 2009-10-01 WO disclosed
WO-2009098252-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2009-08-13 WO disclosed
WO-2009098252-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF BASF SE (DE) 2009-08-13 WO disclosed
WO-2008139452-A2 SELECTIVE BROMINATION OF PERYLENE DIIMIDES AND DERIVATIVES THEREOF UNDER MILD CONDITIONS YEDA RESEARCH AND DEVELOPMENT CO.LTD (IL) 2008-11-20 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 (5 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 CYP1B1 4419/4885TERT 1542/4885PIN1 143/4885
US-20100261901-A1 SELECTIVE BROMINATION OF PERYLENE DIIMIDES AND DERIVATIVES THEREOF UNDER MILD CONDITIONS BAZ2A, BAZ2B, BRD2 CYP1B1 251/4885TERT 1416/4885PIN1 35/4885
US-20100319778-A1 PERYLENE SEMICONDUCTORS AND METHODS OF PREPARATION AND USE THEREOF CDYL, PNN, CPNE4 CYP1B1 1024/4885TERT 1226/4885PIN1 233/4885
US-10454037-B2 Organic semiconductor composition comprising a liquid medium CRY1, NEFM, OR10J3 CYP1B1 4419/4885TERT 1542/4885PIN1 143/4885
US-10224485-B2 Process for preparing a crystalline organic semiconductor material STOM, SPOP, TTR CYP1B1 3699/4885TERT 2496/4885PIN1 34/4885

“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.