SCHEMBL3259108

SCHEMBL3259108

Fc1ccccc1C1NC(=S)NC1c1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM1A O60341 2/20 0.42
KDM1B Q8NB78 1/20 0.42
TNKS2 Q9H2K2 2/20 0.42
GAA P10253 5/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
AR P10275 1/20 0.39
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
PBRM1 Q86U86 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
PDE6D O43924 2/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL3259104 1.00 MEN1 (0.48) MEN1KMT2AKDM1AKDM1BTNKS2
SCHEMBL3255028 0.76 GAA (0.42) MEN1KMT2AKDM1AGAAALDH1A1
SCHEMBL3255808 0.76 P2RX7 (0.42) MEN1KMT2ATNKS2GAAALDH1A1
SCHEMBL3254408 0.76 HTR2C (0.47) MEN1KMT2ATNKS2ALDH1A1NPSR1
SCHEMBL3255023 0.76 GAA (0.42) MEN1KMT2AKDM1AGAAALDH1A1
SCHEMBL3255811 0.76 P2RX7 (0.42) MEN1KMT2ATNKS2GAAALDH1A1
SCHEMBL24282699 0.70 KDM1A (0.49) MEN1KMT2AKDM1AKDM1BTNKS2
SCHEMBL21057914 0.70 KDM1A (0.49) MEN1KMT2AKDM1AKDM1BTNKS2
SCHEMBL21104020 0.70 KDM1A (0.49) MEN1KMT2AKDM1AKDM1BTNKS2
SCHEMBL21057917 0.70 KDM1A (0.49) MEN1KMT2AKDM1AKDM1BTNKS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7741493-B2 4,5-diphenyl-2-amino-4,5-dihydro-imidazole derivatives; antiinflammatory agent, neurodegenerative diseases; inflammatory bowel disease, rheumatoid arthritis and diseases associated with central nervous system, such as Alzheimer's disease AVENTIS PHARMACEUTICALS INC. (US) 2010-06-22 US disclosed
EP-1651613-B1 4,5-DIHYDRO-IMIDAZOLE AS P2X7 ION CHANNEL BLOCKERS AVENTIS PHARMA INC (US) 2010-05-26 EP disclosed
US-20080132550-A1 HETEROCYCLIC COMPOUNDS AS P2X7 ION CHANNEL BLOCKERS AVENTIS PHARMACEUTICALS INC. (US) 2008-06-05 US disclosed
US-7326792-B2 Heterocyclic compounds as P2X7 ion channel blockers AVENTIS PHARMACEUTICALS INC. (US) 2008-02-05 US disclosed
EP-1651613-A1 4,5-DIHYDRO-IMIDAZOLE AS P2X7 ION CHANNEL BLOCKERS Aventis Pharmaceuticals, Inc. (US) 2006-05-03 EP disclosed
WO-2005014555-A1 4,5-DIHYDRO-IMIDAZOLE AS P2X7 ION CHANNEL BLOCKERS AVENTIS PHARMACEUTICALS INC. (US) 2005-02-17 WO disclosed
US-20050026916-A1 Heterocyclic compounds as P2X7 ion channel blockers AVENTIS PHARMACEUTICALS INC. (US) 2005-02-03 US 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-20080132550-A1 HETEROCYCLIC COMPOUNDS AS P2X7 ION CHANNEL BLOCKERS P2RX3, P2RX2, P2RX5 MEN1 3313/4885KMT2A 3229/4885KDM1A 2282/4885
US-20050026916-A1 Heterocyclic compounds as P2X7 ion channel blockers P2RX3, P2RX2, P2RX5 MEN1 3313/4885KMT2A 3229/4885KDM1A 2282/4885

“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.