SCHEMBL9419249

SCHEMBL9419249

CCc1ccc(O)c(F)c1F

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ CACNA1B Q00975 1/20 0.41
▸ APBA1 Q02410 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ HKDC1 Q2TB90 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GABRA1 P14867 1/20 0.41
▸ GABRB2 P47870 1/20 0.41
▸ ESR1 P03372 5/20 0.41

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
SCHEMBL10335750 0.90 P2RX7 (0.37) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL19196278 0.84 GABRA1 (0.39) GABRA1GABRB2FEN1
SCHEMBL23079390 0.84 GABRA1 (0.44) GABRA1GABRB2ESR1ESR2PRKCI
SCHEMBL4517211 0.84 GABRA1 (0.56) MCL1GABRA1GABRB2
SCHEMBL7761403 0.82 PRKCI (0.47) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL9419304 0.79 TYR (0.58) MEN1MAPTMAPK1HTTKMT2A
SCHEMBL1461903 0.78 KDM4E (0.39) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL9419270 0.77 TYR (0.58) KDM4EMEN1ALDH1A1MAPTHTT
SCHEMBL2139522 0.76 AKR1B1 (0.52) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL1512796 0.76 PIM1 (0.41) KDM4EMEN1ALDH1A1POLBMAPT

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103333697-B Nematic negative liquid crystal containing 2,3,5,6-tetrafluorotolane, synthetic method and application FUJIAN SHAOWU YONGJING CHEMICAL CO LTD 2015-06-03 — — CN claimed
CN-103333697-A Nematic negative liquid crystal containing 2,3,5,6-tetrafluorotolane, synthetic method and application Shanghai tianwen chemical co ltd 2013-10-02 — — CN claimed
US-5087764-A Deprotonation of a 1-substituted-2,3-difluorobenzene using an organometallic compound and reacting the reaction product with an electrophile Merck Patent Gesellschaft mit beschrankter Hafung (DE) 1992-02-11 — — US claimed
EP-4026860-A1 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, AND METHOD FOR MANUFACTURING BIO-ELECTRODE Shin-Etsu Chemical Co., Ltd. (JP) 2022-07-13 — — EP disclosed
EP-4015598-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME AND COMPOUNDS Merck Patent GmbH (DE) 2022-06-22 — — EP disclosed
US-10221114-B2 Liquid crystal compound having tetrafluoro cyclohexadiene structure showing negative anisotropy, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2019-03-05 — — US disclosed
US-20160200980-A1 LIQUID CRYSTAL COMPOUND HAVING TETRAFLUORO CYCLOHEXADIENE STRUCTURE SHOWING NEGATIVE ANISOTROPY, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-07-14 — — US disclosed
US-20160200980-A1 LIQUID CRYSTAL COMPOUND HAVING TETRAFLUORO CYCLOHEXADIENE STRUCTURE SHOWING NEGATIVE ANISOTROPY, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2016-07-14 — — US disclosed
CN-103333697-B Nematic negative liquid crystal containing 2,3,5,6-tetrafluorotolane, synthetic method and application FUJIAN SHAOWU YONGJING CHEMICAL CO LTD 2015-06-03 — — CN disclosed
CN-103333697-A Nematic negative liquid crystal containing 2,3,5,6-tetrafluorotolane, synthetic method and application Shanghai tianwen chemical co ltd 2013-10-02 — — CN disclosed
EP-0363458-B1 2,3-DIFLUOROBENZENES MERCK PATENT GMBH (DE) 1994-08-03 — — EP disclosed
US-5087764-A Deprotonation of a 1-substituted-2,3-difluorobenzene using an organometallic compound and reacting the reaction product with an electrophile Merck Patent Gesellschaft mit beschrankter Hafung (DE) 1992-02-11 — — US disclosed
EP-0400068-A1 DERIVATIVES OF 2,3-DIFLUOROPHENOL MERCK PATENT GmbH (DE) 1990-12-05 — — EP disclosed
WO-1989008632-A1 DERIVATIVES OF 2,3-DIFLUOROPHENOL MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1989-09-21 — — 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 (2 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-20160200980-A1 LIQUID CRYSTAL COMPOUND HAVING TETRAFLUORO CYCLOHEXADIENE STRUCTURE SHOWING NEGATIVE ANISOTROPY, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE OCIAD2, CNOT1, OCIAD1 KDM4E 4306/4885MEN1 2404/4885ALDH1A1 1621/4885
US-10221114-B2 Liquid crystal compound having tetrafluoro cyclohexadiene structure showing negative anisotropy, liquid crystal composition, and liquid crystal display device OCIAD2, CNOT1, OCIAD1 KDM4E 4306/4885MEN1 2404/4885ALDH1A1 1621/4885

“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.

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