SCHEMBL6468220

SCHEMBL6468220

CCc1ccc(OC(F)(F)F)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.46
EPHX2 P34913 1/20 0.46
HCRTR1 O43613 6/20 0.42
HCRTR2 O43614 6/20 0.42
CACNA1H O95180 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
P2RX7 Q99572 2/20 0.39

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
SCHEMBL9060560 0.86 CYP17A1 (0.46) PDE2AEPHX2HCRTR1HCRTR2CACNA1H
SCHEMBL12199925 0.86 CYP17A1 (0.46) PDE2AEPHX2HCRTR1HCRTR2CACNA1H
SCHEMBL13557302 0.86 PDE2A (0.44) PDE2AEPHX2HCRTR1HCRTR2
SCHEMBL8225438 0.85 SIGMAR1 (0.42)
SCHEMBL22185629 0.85 SLC6A4 (0.45) PPARDPPARA
SCHEMBL3158031 0.85 CYP1A2 (0.41) PDE2AEPHX2CACNA1HPPARD
SCHEMBL14749509 0.84 PDE2A (0.34) PDE2AHCRTR1HCRTR2
SCHEMBL14749517 0.84 KIF11 (0.35) PDE2APPARDPPARA
SCHEMBL14749522 0.84 PPARD (0.36) CACNA1HPPARDPPARA
SCHEMBL6666327 0.83 PDE2A (0.38) PDE2AEPHX2HCRTR1HCRTR2CACNA1H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230157287-A1 PESTICIDAL COMPOUNDS BASF SE (DE) 2023-05-25 US disclosed
US-20230137110-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-05-04 US disclosed
WO-2022136914-A1 TYK2 INHIBITORS AND USES THEREOF SUDO BIOSCIENCES LIMITED (GB) 2022-06-30 WO disclosed
US-20220140252-A1 NOVEL ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Beijing Summer Sprout Technology Co., Ltd. (CN) 2022-05-05 US disclosed
US-20220020935-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Beijing Summer Sprout Technology Co., Ltd. (CN) 2022-01-20 US disclosed
US-10428049-B2 TRPA1 modulators ALGOMEDIX, INC. (US) 2019-10-01 US disclosed
US-20190016701-A1 TRPA1 MODULATORS ALGOMEDIX, INC. (US) 2019-01-17 US disclosed
US-9951046-B2 TRPA1 modulators ALGOMEDIX, INC. (US) 2018-04-24 US disclosed
US-9382258-B2 Agents for treating pain and uses thereof ABBVIE INC. (US) 2016-07-05 US disclosed
US-9309260-B2 Inhibitors of hepatitis C virus PRESIDIO PHARMACEUTICALS, INC. (US) 2016-04-12 US disclosed
US-20130302282-A1 Inhibitors of Hepatitis C Virus PRESIDIO PHARMACEUTICALS, INC. (US) 2013-11-14 US disclosed
US-20130123262-A1 NOVEL TRIAZINEDIONE DERIVATIVES AS GABAB RECEPTOR MODULATORS ADDEX PHARMA S.A. (CH) 2013-05-16 US disclosed
US-20130072471-A1 Inhibitors of Ion Channels MARRON BRIAN EDWARD (US) 2013-03-21 US disclosed
US-8357711-B2 Heterocyclic sulfonamides as inhibitors of ion channels PFIZER LIMITED (GB) 2013-01-22 US disclosed
US-20120251497-A1 INHIBITORS OF HEPATITIS C VIRUS PRESIDIO PHARMACEUTICALS, INC. 2012-10-04 US disclosed
US-20120108595-A1 PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2012-05-03 US disclosed
EP-1995241-B1 Inhibitors of ion channels ICAGEN INC (US) 2010-03-17 EP disclosed
US-20090143358-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (US) 2009-06-04 US disclosed
EP-1995241-A1 Inhibitors of ion channels ICAgen, Incorporated (US) 2008-11-26 EP disclosed
WO-2008118758-A1 INHIBITORS OF ION CHANNELS ICAGEN, INC. (GB) 2008-10-02 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 (12 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-20120108595-A1 PLATELET-ACTIVATING FACTOR RECEPTOR ANTAGONISTS PTAFR, PAFAH1B2, PAFAH1B3 PDE2A 1145/4885EPHX2 562/4885HCRTR1 2666/4885
US-10428049-B2 TRPA1 modulators TRPA1, TRPV1, TRPV2 PDE2A 883/4885EPHX2 1414/4885HCRTR1 204/4885
US-20230137110-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF SLCO2B1, SLCO2A1, SLCO1B3 PDE2A 2936/4885EPHX2 765/4885HCRTR1 4533/4885
US-20130072471-A1 Inhibitors of Ion Channels TRPV1, TRPV5, TRPA1 PDE2A 1677/4885EPHX2 1928/4885HCRTR1 1224/4885
US-20230157287-A1 PESTICIDAL COMPOUNDS PNMT, CAT, DDT PDE2A 242/4885EPHX2 1776/4885HCRTR1 472/4885
US-20220140252-A1 NOVEL ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES LEF1, PIEZO1, L1CAM PDE2A 2795/4885EPHX2 1088/4885HCRTR1 4186/4885
US-20190016701-A1 TRPA1 MODULATORS TRPA1, TRPV1, TRPV2 PDE2A 883/4885EPHX2 1414/4885HCRTR1 204/4885
US-20130302282-A1 Inhibitors of Hepatitis C Virus HAVCR2, LIPC, HCCS PDE2A 2727/4885EPHX2 2505/4885HCRTR1 4010/4885
US-20090143358-A1 INHIBITORS OF ION CHANNELS TRPV1, TRPV5, TRPA1 PDE2A 1677/4885EPHX2 1928/4885HCRTR1 1224/4885
US-20120251497-A1 INHIBITORS OF HEPATITIS C VIRUS HAVCR2, LIPC, HCCS PDE2A 2727/4885EPHX2 2505/4885HCRTR1 4010/4885
US-20220020935-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, LEF1 PDE2A 4590/4885EPHX2 1703/4885HCRTR1 1799/4885
US-20130123262-A1 NOVEL TRIAZINEDIONE DERIVATIVES AS GABAB RECEPTOR MODULATORS CHRNA5, GABRA5, GABRB3 PDE2A 558/4885EPHX2 3179/4885HCRTR1 172/4885

“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.