SCHEMBL2652565

SCHEMBL2652565

OB(O)c1ccccc1C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.42
PTGS2 P35354 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ENPP2 Q13822 1/20 0.36
HTR2C P28335 2/20 0.36
NOS1 P29475 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
ADRA2A P08913 2/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
USP2 O75604 1/20 0.35
CYP1A2 P05177 1/20 0.35
HTR1A P08908 1/20 0.35
CYP2D6 P10635 1/20 0.35
CHRM1 P11229 1/20 0.35
CYP2C9 P11712 1/20 0.35
DRD1 P21728 1/20 0.35
TBXA2R P21731 1/20 0.35

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
SCHEMBL17061132 1.00 PTGDR2 (0.42) PTGDR2PTGS2MEN1KMT2AENPP2
SCHEMBL3787321 0.98 PTGDR2 (0.40) PTGDR2PTGS2MEN1KMT2AENPP2
SCHEMBL29567858 0.94 ENPP2 (0.38) PTGDR2PTGS2MEN1KMT2AENPP2
SCHEMBL3783738 0.94 ENPP2 (0.38) PTGDR2PTGS2MEN1KMT2AENPP2
SCHEMBL3784784 0.90 ENPP2 (0.40) MEN1KMT2AENPP2HTR2CSLC6A4
SCHEMBL29469211 0.90 ENPP2 (0.40) MEN1KMT2AENPP2HTR2CSLC6A4
SCHEMBL22249252 0.84 NOS3 (0.33) PTGDR2PTGS2MEN1KMT2AENPP2
SCHEMBL3789806 0.83 ABCB1 (0.39) PTGDR2PTGS2MEN1KMT2AHTR1A
SCHEMBL28591184 0.83 PTGS2 (0.45) PTGDR2PTGS2MEN1KMT2A
SCHEMBL30002535 0.83 ABCB1 (0.39) PTGDR2PTGS2MEN1KMT2AHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109021022-B Luminescent diazabenzimidazole carbene metal complexes UDC 爱尔兰有限责任公司 2021-04-16 CN disclosed
US-20170331054-A1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC IRELAND LTD (IE) 2017-11-16 US disclosed
US-20170331054-A1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC IRELAND LTD (IE) 2017-11-16 US disclosed
US-20170331054-A1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC IRELAND LTD (IE) 2017-11-16 US disclosed
EP-3239161-A1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC Ireland Limited (IE) 2017-11-01 EP disclosed
EP-3239161-A1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC Ireland Limited (IE) 2017-11-01 EP disclosed
EP-3027629-B1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC IRELAND LTD (IE) 2017-06-14 EP disclosed
EP-3027629-B1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES UDC IRELAND LTD (IE) 2017-06-14 EP disclosed
US-9673408-B2 Luminescent diazabenzimidazole carbene metal complexes UDC IRELAND LIMITED (IE) 2017-06-06 US disclosed
US-9673408-B2 Luminescent diazabenzimidazole carbene metal complexes UDC IRELAND LIMITED (IE) 2017-06-06 US disclosed
EP-1778632-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-05-02 EP disclosed
WO-2006086488-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-08-17 WO disclosed
US-7038070-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2006-05-02 US disclosed
WO-2005123673-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2005-12-29 WO disclosed
US-6963017-B2 Preparation of preparing substituted indanones BASELL POLYOLEFINE GMBH (DE) 2005-11-08 US disclosed
EP-0968158-B1 METHOD OF PREPARING SUBSTITUTED INDANONES, THE SUBSTITUTED INDANONES AND METALLOCENES PREPARED THEREFROM BASELL POLYOLEFINE GMBH (DE) 2005-08-10 EP disclosed
US-20050033076-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2005-02-10 US disclosed
US-20050014816-A1 Thiophene amino acid derivatives, process for preparing them and pharmaceutical compositions containing them PFIZER INC 2005-01-20 US disclosed
WO-2005003115-A1 THIOPHENE AMINO ACID DERIVATIVES, PROCESS FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM WARNER-LAMBERT COMPANY LLC (US) 2005-01-13 WO disclosed
US-20030009046-A1 Preparation of preparing substituted indanones EQUISTAR CHEMICALS, LP 2003-01-09 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 (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-20170331054-A1 LUMINESCENT DIAZABENZIMIDAZOLE CARBENE METAL COMPLEXES OCIAD1, OCIAD2, CACNA1D PTGDR2 790/4885PTGS2 3479/4885MEN1 1291/4885
US-20050033076-A1 Preparation of preparing substituted indanones CYP1A2, CYP2J2, IDH3A PTGDR2 735/4885PTGS2 405/4885MEN1 718/4885
US-20050014816-A1 Thiophene amino acid derivatives, process for preparing them and pharmaceutical compositions containing them MMP12, MMP9, MMP13 PTGDR2 783/4885PTGS2 421/4885MEN1 2395/4885
US-20030009046-A1 Preparation of preparing substituted indanones CYP1A2, CYP1B1, CYP1A1 PTGDR2 863/4885PTGS2 443/4885MEN1 614/4885

“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.