SCHEMBL3201324

SCHEMBL3201324

CC(=N)Nc1ccc2sc(-c3ccc(Cl)c(Cl)c3)cc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF2AK2 P19525 6/20 0.41
KDM4E B2RXH2 2/20 0.41
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
PDGFRB P09619 4/20 0.41
KDR P35968 4/20 0.41
CNR1 P21554 2/20 0.40
HDAC6 Q9UBN7 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC2 Q92769 1/20 0.39
ABL1 P00519 1/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36

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
SCHEMBL3194172 0.87 HDAC6 (0.41) EIF2AK2KDM4ERAB9AKMT2AMAPT
SCHEMBL3202698 0.84 CNR1 (0.42) EIF2AK2RAB9APDGFRBKDRCNR1
SCHEMBL3190477 0.82 HDAC6 (0.41) EIF2AK2KDM4ERAB9AKMT2AMAPT
SCHEMBL3196705 0.81 ESR1 (0.44) MAPTPDGFRBKDRHDAC6HDAC1
SCHEMBL3191971 0.80 PDGFRB (0.44) EIF2AK2PDGFRBKDRCNR1
SCHEMBL3203960 0.80 HDAC6 (0.56) KDM4ERAB9AMAPTLMNACNR1
SCHEMBL3183267 0.79 ESRRG (0.44) MAPTCNR1HDAC6TP53
SCHEMBL3205101 0.78 APP (0.47) KDM4ERAB9AKMT2AMAPTHDAC6
SCHEMBL3194962 0.77 HDAC6 (0.45) RAB9AKMT2AMAPTCNR1HDAC6
SCHEMBL3195174 0.72 NPC1 (0.46) KDM4ERAB9AKMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100120802-A1 Novel Anti-Inflammatory and Analgesic Heterocyclic Amidines that Inhibit Nitrogen Oxide (NO) Production MAKOVEC FRANCESCO 2010-05-13 US disclosed
US-7674809-B2 Anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production ROTTAPHARM S.P.A. (IT) 2010-03-09 US disclosed
US-20050197331-A1 Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production ROTTAPHARM SPA 2005-09-08 US disclosed
EP-1571142-A1 Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production Rottapharm S.p.A. (IT) 2005-09-07 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 (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-20100120802-A1 Novel Anti-Inflammatory and Analgesic Heterocyclic Amidines that Inhibit Nitrogen Oxide (NO) Production NOS3, NOS1, NOS2 EIF2AK2 396/4885KDM4E 3052/4885RAB9A 2198/4885
US-20050197331-A1 Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production NOS3, NOS1, NOS2 EIF2AK2 396/4885KDM4E 3052/4885RAB9A 2198/4885

“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.