SCHEMBL2678110

SCHEMBL2678110

CC(c1ccc(N)cc1)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 6/20 0.38
TDP1 Q9NUW8 5/20 0.38
KDM4E B2RXH2 2/20 0.38
KIF11 P52732 1/20 0.38
PDE2A O00408 1/20 0.36
DEGS1 O15121 1/20 0.36
ACHE P22303 1/20 0.36
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
GAA P10253 2/20 0.34
ALOX12 P18054 1/20 0.34
HTT P42858 1/20 0.34
HIF1A Q16665 1/20 0.34
TP53 P04637 3/20 0.33
POLB P06746 2/20 0.33
CYP3A4 P08684 2/20 0.33
NPC1 O15118 2/20 0.33

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
SCHEMBL16785292 0.85 PTPN5 (0.41) ALDH1A1KDM4EPDE2ADEGS1ESR1
SCHEMBL13852045 0.78 IDO1 (0.39) ALDH1A1KDM4EPDE2ADEGS1ACHE
SCHEMBL12602992 0.78 CHRNA7 (0.41) MAPTTDP1PDE2ADEGS1ACHE
SCHEMBL10194742 0.78 IDO1 (0.39) ALDH1A1KDM4EPDE2ADEGS1ACHE
SCHEMBL7899070 0.76 ESR1 (0.62) MEN1MAPTKMT2AALDH1A1TDP1
SCHEMBL15575588 0.76 CYP2A6 (0.38) ALDH1A1DEGS1ESR1ESR2POLB
SCHEMBL13852046 0.76 ADRB2 (0.50) MEN1KMT2ATDP1DEGS1ESR1
SCHEMBL34472369 0.76 TAAR1 (0.54) PDE2ADEGS1ESR1ESR2
SCHEMBL34472200 0.76 PDE2A (0.46) PDE2ADEGS1ESR1ESR2
SCHEMBL8090925 0.75 TAAR1 (0.41) ALDH1A1KDM4EHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111321480-B Low-dielectric polyimide fiber, preparation method and application 航天科工(长沙)新材料研究院有限公司 2022-10-21 CN claimed
CN-114230790-A Polyimide powder and preparation method thereof 长沙新材料产业研究院有限公司 2022-03-25 CN claimed
CN-111321480-A Low-dielectric polyimide fiber, preparation method and application 长沙新材料产业研究院有限公司 2020-06-23 CN claimed
CN-111321480-B Low-dielectric polyimide fiber, preparation method and application 航天科工(长沙)新材料研究院有限公司 2022-10-21 CN disclosed
CN-114230790-A Polyimide powder and preparation method thereof 长沙新材料产业研究院有限公司 2022-03-25 CN disclosed
CN-111321480-A Low-dielectric polyimide fiber, preparation method and application 长沙新材料产业研究院有限公司 2020-06-23 CN disclosed
US-8338603-B2 TRPV1 antagonists ABBVIE INC. (US) 2012-12-25 US disclosed
US-8173638-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-08 US disclosed
US-8173638-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-08 US disclosed
US-8173638-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-08 US disclosed
US-20120108642-A1 TRPV1 ANTAGONISTS ABBVIE INC. 2012-05-03 US disclosed
WO-2008064054-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-05-29 WO disclosed
EP-1581225-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN NEUROGEN CORPORATION (US) 2005-10-05 EP disclosed
US-20040176443-A1 Capsaicin receptor ligands NEUROGEN CORPORATION 2004-09-09 US disclosed
US-20040142958-A1 Combination therapy for the treatment of pain NEUROGEN CORPORATION 2004-07-22 US disclosed
WO-2004054582-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN NEUROGEN CORPORATION (US) 2004-07-01 WO disclosed
US-6723730-B2 DIARYL PIPERAZINES AND RELATED COMPOUNDS USEFUL IN THE TREATMENT OF A CHRONIC AND ACUTE PAIN CONDITIONS, ITCH AND URINARY INCONTINENCE. NEUROGEN CORPORATION 2004-04-20 US disclosed
EP-1301484-A2 CAPSAICIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 2003-04-16 EP disclosed
US-20020132853-A1 Capsaicin receptor ligands NEUROGEN CORPORATION 2002-09-19 US disclosed
WO-2002008221-A2 CAPSAICIN RECEPTOR LIGANDS NEUROGEN CORPORATION (US) 2002-01-31 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-20040176443-A1 Capsaicin receptor ligands TRPV1, TRPV5, TRPV2 MEN1 4876/4885MAPT 3250/4885KMT2A 3839/4885
US-20040142958-A1 Combination therapy for the treatment of pain OPRK1, OPRL1, OPRM1 MEN1 4577/4885MAPT 3949/4885KMT2A 2232/4885
US-20120108642-A1 TRPV1 ANTAGONISTS TRPV1, TRPV5, TRPV3 MEN1 3210/4885MAPT 1809/4885KMT2A 3985/4885
US-20020132853-A1 Capsaicin receptor ligands TRPV1, TRPV5, TRPV2 MEN1 4876/4885MAPT 3250/4885KMT2A 3839/4885

“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.