SCHEMBL1705418

SCHEMBL1705418

FC(F)(F)c1ccc2oc(S)nc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
PIM1 P11309 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
AGPAT2 O15120 1/20 0.40
PTPN2 P17706 3/20 0.39
PTPN1 P18031 3/20 0.39
PTPN5 P54829 3/20 0.39
HSPD1 P10809 2/20 0.39
HSPE1 P61604 2/20 0.39
BACE1 P56817 1/20 0.39
F7 P08709 1/20 0.38
F3 P13726 1/20 0.38
AKR1B1 P15121 1/20 0.37
UTRN P46939 1/20 0.37
EPHX2 P34913 2/20 0.37

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
SCHEMBL31208289 1.00 KDM4E (0.42) KDM4EPIM1PIM2HDAC3HDAC1
Methane SCHEMBL11094670 0.98 HDAC3 (0.43) KDM4EPIM1PIM2HDAC3HDAC1
SCHEMBL31208302 0.86 BACE1 (0.42) KDM4EPIM1PIM2BACE1F7
SCHEMBL18755165 0.86 BACE1 (0.42) KDM4EPIM1PIM2BACE1F7
SCHEMBL29594055 0.82 NPC1 (0.48) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3072919 0.82 NPC1 (0.48) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL19899503 0.79 HDAC3 (0.44) KDM4EPIM1PIM2HDAC3HDAC1
SCHEMBL7988985 0.79 L3MBTL1 (0.51) KDM4EPIM1PIM2HDAC3HDAC1
SCHEMBL3080166 0.79 AGPAT2 (0.45) KDM4EPIM1PIM2HDAC3HDAC1
SCHEMBL30238039 0.79 LMNA (0.56) KDM4EPIM1PIM2HDAC3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250051319-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2025-02-13 US disclosed
US-20240409533-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2024-12-12 US disclosed
US-12071433-B2 HMOX1 inducers Astellas Engineered Small Molecules US, Incorporated (US) 2024-08-27 US disclosed
US-20240051952-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2024-02-15 US disclosed
US-20230312878-A1 RUBBER COMPOSITION AND CROSSLINKED RUBBER MOLDED PRODUCT SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2023-10-05 US disclosed
US-20230242512-A1 ISOINDOLINES AS HDAC INHIBITORS VALO HEALTH, INC. 2023-08-03 US disclosed
US-20230242512-A1 ISOINDOLINES AS HDAC INHIBITORS VALO HEALTH, INC. 2023-08-03 US disclosed
WO-2023118507-A2 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2023-06-29 WO disclosed
US-11535607-B2 Isoindolines as HDAC inhibitors VALO HEALTH, INC. (US) 2022-12-27 US disclosed
US-20220177460-A1 HMOX1 INDUCERS Astellas Engineered Small Molecules US, Incorporated 2022-06-09 US disclosed
US-6362208-B1 ANTICHOLESTEROL AGENT KOWA COMPANY, LTD. (JP) 2002-03-26 US disclosed
US-6333328-B1 MIXING BENZOXAZOLE DERIVATIVE WITH CARRIER TO FORM ACTIVATOR COMPOUND MEIJI SEIKA KAISHA, LTD. (JP) 2001-12-25 US disclosed
US-6297246-B1 BENZOXAZOLE DERIVATIVES; DOES NOT CAUSE CONSTIPATION AS A SIDE EFFECT. MEIJI SEIKA KAISHA LTD. (JP) 2001-10-02 US disclosed
US-20010016579-A1 Serotonin 5-HT, receptor partial activator LOTUS PHARMACEUTICAL CO., LTD. (JP) 2001-08-23 US disclosed
EP-1020451-A1 NOVEL ANILIDE COMPOUNDS AND DRUGS CONTAINING THE SAME Kowa Co., Ltd. (JP) 2000-07-19 EP disclosed
US-6037342-A BENZOXAZOLE DERIVATIVES HAVING STRONG SEROTONIN 5-HT.SUB.3 RECEPTOR ANTAGONISM; TREATING FUNCTIONAL DISORDERS OF DIGESTIVE ORGANS MEIJI SEIKA KAISHA, LTD (JP) 2000-03-14 US disclosed
EP-0806419-A1 Benzoxazole derivatives as serotonin 5-HT3 receptor partial activator MEIJI SEIKA KAISHA LTD. (JP) 1997-11-12 EP disclosed
EP-0018080-B1 HERBICIDAL COMPOUNDS, THEIR PREPARATION, COMPOSITIONS AND PROCESS FOR THE USE THEREOF ICI AUSTRALIA LIMITED (AU) 1984-03-14 EP disclosed
US-4314065-A HERBICIDES ICI AUSTRALIA LIMITED (AU) 1982-02-02 US disclosed
EP-0018080-A1 Herbicidal compounds, their preparation, compositions and process for the use thereof ICI AUSTRALIA LIMITED (AU) 1980-10-29 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-11535607-B2 Isoindolines as HDAC inhibitors HDAC1, HDAC2, HDAC3 KDM4E 223/4885PIM1 4147/4885PIM2 3686/4885
US-20010016579-A1 Serotonin 5-HT, receptor partial activator HTR7, HTR1A, HTR3A KDM4E 1908/4885PIM1 4592/4885PIM2 4611/4885
US-20230242512-A1 ISOINDOLINES AS HDAC INHIBITORS HDAC1, HDAC2, HDAC3 KDM4E 204/4885PIM1 4042/4885PIM2 3552/4885
US-20250051319-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS HDAC6, HDAC9, HDAC1 KDM4E 2750/4885PIM1 4000/4885PIM2 4098/4885
US-20240409533-A1 HMOX1 INDUCERS HMOX1, HMOX2, HMBS KDM4E 2510/4885PIM1 3599/4885PIM2 4326/4885
US-12071433-B2 HMOX1 inducers HMOX1, HMOX2, HMBS KDM4E 2606/4885PIM1 3553/4885PIM2 4396/4885
US-20240051952-A1 HMOX1 INDUCERS HMOX1, HMOX2, QSOX1 KDM4E 4001/4885PIM1 3477/4885PIM2 4589/4885
US-20220177460-A1 HMOX1 INDUCERS HMOX1, HMOX2, HMBS KDM4E 2606/4885PIM1 3553/4885PIM2 4396/4885

“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.