SCHEMBL994038

SCHEMBL994038

Cc1c(Br)cccc1NC(=O)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 4/20 0.53
PDK2 Q15119 4/20 0.53
PDK3 Q15120 4/20 0.53
PDK4 Q16654 4/20 0.53
MAPT P10636 3/20 0.47
JAK2 O60674 1/20 0.47
TP53 P04637 1/20 0.47
HTT P42858 1/20 0.47
KLK7 P49862 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
PARP14 Q460N5 1/20 0.42
HDAC1 Q13547 2/20 0.41
HDAC7 Q8WUI4 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL6029980 0.83 PDK1 (0.53) PDK1PDK2PDK3PDK4MAPT
SCHEMBL30641363 0.82 PDK1 (0.68) PDK1PDK2PDK3PDK4MAPT
SCHEMBL1179607 0.82 PDK1 (0.68) PDK1PDK2PDK3PDK4MAPT
SCHEMBL6367216 0.81 SMN1; SMN2 (0.56) PDK1PDK2PDK3PDK4MAPT
SCHEMBL8403273 0.81 HTT (0.48) PDK1PDK2PDK3PDK4MAPT
SCHEMBL17495017 0.80 NPC1 (0.46) PDK1PDK2PDK3PDK4MAPT
SCHEMBL19785319 0.80 PDK1 (0.50) PDK1PDK2PDK3PDK4MAPT
SCHEMBL265392 0.79 ALDH1A1 (0.55) LMNAPOLBSMN1; SMN2NPC1RAB9A
SCHEMBL994902 0.78 PDK1 (0.47) PDK1PDK2PDK3PDK4MAPT
SCHEMBL23885494 0.77 L3MBTL1 (0.47) PDK1PDK2PDK3PDK4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12319682-B2 Indole and benzimidazole derivatives as dual 5-HT2A and 5-HT6 receptor antagonists ADAMED PHARMA S.A. (PL) 2025-06-03 US disclosed
US-20240287056-A1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT 2A AND 5-HT6 RECEPTOR ANTAGONISTS Adamed Pharma S.A (PL) 2024-08-29 US disclosed
US-11981668-B2 Indole and benzimidazole derivatives as dual 5-HT2A and 5-HT6 receptor antagonists ADAMED PHARMA S.A. (PL) 2024-05-14 US disclosed
EP-3755688-B1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT2A AND 5-HT6 RECEPTOR ANTAGONISTS ADAMED PHARMA S A (PL) 2023-06-14 EP disclosed
EP-3755688-B1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT2A AND 5-HT6 RECEPTOR ANTAGONISTS ADAMED PHARMA S A (PL) 2023-06-14 EP disclosed
US-20210276995-A1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT2A AND 5-HT6 RECEPTOR ANTAGONISTS ADAMED PHARMA S.A. (PL) 2021-09-09 US disclosed
US-11034688-B2 Indole and benzimidazole derivatives as dual 5-HT2A and 5-HT6 receptor antagonists ADAMED PHARMA S.A. (PL) 2021-06-15 US disclosed
US-11034688-B2 Indole and benzimidazole derivatives as dual 5-HT2A and 5-HT6 receptor antagonists ADAMED PHARMA S.A. (PL) 2021-06-15 US disclosed
CN-112041300-A Indole and benzimidazole derivatives as dual 5-HT2A and5-HT 6receptor antagonists 阿达梅德制药公司 2020-12-04 CN disclosed
US-20200377496-A1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT2A and 5-HT6 RECEPTOR ANTAGONISTS ACADIA PHARMACEUTICALS INC. 2020-12-03 US disclosed
US-8293735-B2 Thienopyrimidine derivatives as P13K inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2012-10-23 US disclosed
US-8252792-B2 Pyrimidine derivatives as PI3K inhibitors F. HOFFMAN-LA ROCHE AG (CH) 2012-08-28 US disclosed
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-01-27 US disclosed
US-20100210646-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2010-08-19 US disclosed
EP-2205610-A1 THIENOPYRIMIDIENE DERIVATIVES AS PI3K INHIBITORS F. Hoffmann-Roche AG (CH) 2010-07-14 EP disclosed
EP-2152693-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2010-02-17 EP disclosed
US-20100016306-A1 PYRIMIDINE DERIVATIVES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2010-01-21 US disclosed
WO-2009053715-A1 THIENOPYRIMIDIENE DERIVATIVES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-04-30 WO disclosed
WO-2008152394-A1 PHARMACEUTICAL COMPOUNDS F.HOFFMANN-LA ROCHE AG (CH) 2008-12-18 WO disclosed
WO-2008125835-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS PIRAMED LIMITED (GB) 2008-10-23 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 (9 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-12319682-B2 Indole and benzimidazole derivatives as dual 5-HT2A and 5-HT6 receptor antagonists HTR2A, HTR6, HTR2C PDK1 2312/4885PDK2 495/4885PDK3 1461/4885
US-11981668-B2 Indole and benzimidazole derivatives as dual 5-HT2A and 5-HT6 receptor antagonists HTR2A, HTR2C, HTR6 PDK1 2609/4885PDK2 893/4885PDK3 2048/4885
US-11034688-B2 Indole and benzimidazole derivatives as dual 5-HT2A and 5-HT6 receptor antagonists HTR2A, HTR6, HTR2C PDK1 2312/4885PDK2 495/4885PDK3 1461/4885
US-20100210646-A1 2-MORPHOLIN-4-YL-PYRIMIDINES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB PDK1 183/4885PDK2 169/4885PDK3 490/4885
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS PIK3CA, PIK3CD, PIK3CB PDK1 64/4885PDK2 251/4885PDK3 438/4885
US-20240287056-A1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT 2A AND 5-HT6 RECEPTOR ANTAGONISTS HTR2A, HTR6, HTR2C PDK1 2187/4885PDK2 491/4885PDK3 1390/4885
US-20100016306-A1 PYRIMIDINE DERIVATIVES AS PI3K INHIBITORS PIK3CA, PIK3CD, PIK3CB PDK1 125/4885PDK2 488/4885PDK3 675/4885
US-20200377496-A1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT2A and 5-HT6 RECEPTOR ANTAGONISTS HTR2A, HTR6, HTR2C PDK1 2312/4885PDK2 495/4885PDK3 1461/4885
US-20210276995-A1 INDOLE AND BENZIMIDAZOLE DERIVATIVES AS DUAL 5-HT2A AND 5-HT6 RECEPTOR ANTAGONISTS HTR2A, HTR2C, HTR6 PDK1 2609/4885PDK2 893/4885PDK3 2048/4885

“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.