SCHEMBL146946

SCHEMBL146946

FC(F)(F)c1cc[c]c(I)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35
KIF11 P52732 4/20 0.33
PTPN5 P54829 1/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CES2 O00748 3/20 0.32
PDE2A O00408 2/20 0.32
MGLL Q99685 1/20 0.32
PKM P14618 1/20 0.32
CA2 P00918 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
NOTUM Q6P988 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
SCHEMBL16440009 0.83
SCHEMBL9828749 0.77 ALDH1A1 (0.37) TSHRKIF11ALDH1A1PKM
SCHEMBL146433 0.74 PDE2A (0.37) TSHRMAPK1KIF11PTPN5NOS3
SCHEMBL149760 0.74 TSHR (0.37) TSHRMAPK1KIF11PTPN5NOS3
SCHEMBL148163 0.73 TSHR (0.35) TSHRMAPK1KIF11PTPN5NOS3
SCHEMBL9725680 0.73 TSHR (0.35) TSHRMAPK1KIF11PTPN5NOS3
SCHEMBL95846 0.73 KIF11 (0.36) TSHRMAPK1KIF11PTPN5NOS3
SCHEMBL4852287 0.73 TSHR (0.45) TSHRMAPK1KIF11PTPN5NOS3
SCHEMBL3081819 0.73 MGLL (0.41) TSHRMAPK1KIF11PTPN5NOS3
SCHEMBL101521 0.73 PDE2A (0.36) TSHRMAPK1KIF11PTPN5NOS3

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 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2532663-B1 Naphthalenetetracarboxylic acid derivatives and their use as semiconductors BASF SE (DE) 2016-03-16 EP claimed
EP-2532663-A1 Naphthalenecarboxylic acid derivatives and their use as semiconductors BASF SE (DE) 2012-12-12 EP claimed
US-20240108006-A1 PESTICIDALLY ACTIVE HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-04-04 US disclosed
WO-2024022910-A1 1-[1-[2-(PYRIMIDIN-4-YL)-1,2,4-TRIAZOL-3-YL]ETHYL]-3-[2,4-DICHLORO-5-PHENYL]UREA DERIVATIVES AND SIMILAR COMPOUNDS AS PESTICIDES SYNGENTA CROP PROTECTION AG (CH) 2024-02-01 WO disclosed
CN-117412961-A Pesticidally active heteroaromatic compounds 先正达农作物保护股份公司 2024-01-16 CN disclosed
EP-4281185-A2 PESTICIDALLY ACTIVE HETEROAROMATIC COMPOUNDS Syngenta Crop Protection AG (CH) 2023-11-29 EP disclosed
US-9783523-B2 N-acylimino heterocyclic compounds BASF SE (DE) 2017-10-10 US disclosed
US-20170174676-A1 CHLORINATED NAPTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2017-06-22 US disclosed
US-9512354-B2 Chlorinated naphthalenetetracarboxylic acid derivatives, preparation thereof and use thereof in organic electronics BASF SE (DE) 2016-12-06 US disclosed
US-20160297793-A1 N-ACYLIMINO HETEROCYCLIC COMPOUNDS BASF SE (DE) 2016-10-13 US disclosed
EP-2532663-B1 Naphthalenetetracarboxylic acid derivatives and their use as semiconductors BASF SE (DE) 2016-03-16 EP disclosed
US-20110203649-A1 USE OF INDANTHRENE COMPOUNDS IN ORGANIC PHOTOVOLTAICS BASF SE (DE) 2011-08-25 US disclosed
US-20110068328-A1 HALOGEN-CONTAINING PERYLENETETRACARBOXYLIC ACID DERIVATIVES AND THE USE THEREOF BASF SE (DE) 2011-03-24 US disclosed
EP-2297274-A1 CHLORINATED NAPHTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2011-03-23 EP disclosed
WO-2009147237-A1 CHLORINATED NAPHTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2009-12-10 WO disclosed
US-20090301552-A1 CHLORINATED NAPHTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2009-12-10 US disclosed
US-20090166614-A1 FLUORINATED RYLENETETRACARBOXYLIC ACID DERIVATIVES AND USE THEREOF BASF AKTIENGESELLSCHAFT (DE) 2009-07-02 US disclosed
US-20080300405-A1 Naphthalenetetracarboxylic Aicd Derivatives and their Use as Semiconductors BASF SE (DE) 2008-12-04 US disclosed
EP-1780211-A2 Vanilloid receptor ligands and their use in treatments Amgen Inc. (US) 2007-05-02 EP disclosed
EP-1775295-A1 Vanilloid receptor ligands and their use in treatments Amgen Inc. (US) 2007-04-18 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 (8 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-20110203649-A1 USE OF INDANTHRENE COMPOUNDS IN ORGANIC PHOTOVOLTAICS ICMT, EPCAM, INF2 TSHR 4614/4885MAPK1 4322/4885KIF11 3359/4885
US-20090301552-A1 CHLORINATED NAPHTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS SLCO2A1, SLCO4C1, SLCO2B1 TSHR 1100/4885MAPK1 4361/4885KIF11 555/4885
US-20110068328-A1 HALOGEN-CONTAINING PERYLENETETRACARBOXYLIC ACID DERIVATIVES AND THE USE THEREOF NR0B1, NR0B2, RXRB TSHR 357/4885MAPK1 1374/4885KIF11 1732/4885
US-20170174676-A1 CHLORINATED NAPTHALENETETRACARBOXYLIC ACID DERIVATIVES, PREPARATION THEREOF AND USE THEREOF IN ORGANIC ELECTRONICS SLCO2A1, SLCO2B1, SLC43A3 TSHR 1739/4885MAPK1 4301/4885KIF11 1256/4885
US-20080300405-A1 Naphthalenetetracarboxylic Aicd Derivatives and their Use as Semiconductors ADSL, ALAD, EED TSHR 4522/4885MAPK1 4790/4885KIF11 1865/4885
US-20240108006-A1 PESTICIDALLY ACTIVE HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 TSHR 2069/4885MAPK1 1760/4885KIF11 3883/4885
US-20090166614-A1 FLUORINATED RYLENETETRACARBOXYLIC ACID DERIVATIVES AND USE THEREOF FXR2, FXR1, FTO TSHR 810/4885MAPK1 2994/4885KIF11 1415/4885
US-20160297793-A1 N-ACYLIMINO HETEROCYCLIC COMPOUNDS CBR3, C5, ALOX5 TSHR 2179/4885MAPK1 3729/4885KIF11 4693/4885

“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.