SCHEMBL3203140

SCHEMBL3203140

CC(=N)Nc1ccc2oc(-c3ccccc3Cl)cc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.43
TDP1 Q9NUW8 2/20 0.43
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
NPC1 O15118 6/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
LMNA P02545 5/20 0.41
HPGD P15428 4/20 0.41
MAPT P10636 4/20 0.41
NFKB1 P19838 2/20 0.41
NFKB2 Q00653 2/20 0.41
RELA Q04206 2/20 0.41
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
PIM1 P11309 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
PIM3 Q86V86 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
ALDH1A1 P00352 4/20 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
SCHEMBL3202713 0.86 MAOB (0.44) RAB9AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL3198919 0.85 MAOB (0.48) RAB9AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL3201207 0.82 MAOB (0.50) RAB9ATDP1MEN1KMT2ANPC1
SCHEMBL3184553 0.81 MAOB (0.55) RAB9AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL3195174 0.80 NPC1 (0.46) RAB9AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL3191644 0.79 NPC1 (0.57) RAB9ATDP1MEN1KMT2ANPC1
SCHEMBL3183929 0.79 PTGS2 (0.52) RAB9ATDP1MEN1KMT2ANPC1
SCHEMBL3201639 0.78 KDR (0.62) RAB9ANPC1SMN1; SMN2HPGDMAPT
SCHEMBL3207301 0.75 CASP3 (0.53) RAB9AMEN1KMT2ANPC1SMN1; SMN2
SCHEMBL15157601 0.75 ESR1 (0.56) RAB9ATDP1MEN1KMT2ANPC1

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 RAB9A 2198/4885TDP1 4289/4885MEN1 3366/4885
US-20050197331-A1 Novel anti-inflammatory and analgesic heterocyclic amidines that inhibit nitrogen oxide (NO) production NOS3, NOS1, NOS2 RAB9A 2198/4885TDP1 4289/4885MEN1 3366/4885

“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.