SCHEMBL380712

SCHEMBL380712

Nc1ccn(-c2cc(F)cc(F)c2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
STS P08842 1/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MPO P05164 1/20 0.35
TPO P07202 1/20 0.35
CYP3A4 P08684 1/20 0.35
BACE1 P56817 1/20 0.33
KEAP1 Q14145 1/20 0.33
KAT6A Q92794 2/20 0.33
KCNH2 Q12809 2/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
KDM4E B2RXH2 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30

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
SCHEMBL2360049 0.83 KEAP1 (0.53) L3MBTL1STSKEAP1NPC1RAB9A
SCHEMBL20241942 0.82 ELOVL1 (0.44) L3MBTL1KMT2AMEN1ALDH1A1MPO
SCHEMBL2159964 0.82 KMT2A (0.49) L3MBTL1KMT2AMEN1ALDH1A1MPO
SCHEMBL2130372 0.77 FAAH (0.39) L3MBTL1KMT2AMEN1ALDH1A1MPO
SCHEMBL30780893 0.76 ALDH1A1 (0.40) ALDH1A1CYP3A4BACE1
Trifluoroacetic Acid SCHEMBL31456974 0.75 KLKB1 (0.37) L3MBTL1KMT2AKAT6AKDM4E
SCHEMBL27097065 0.74 L3MBTL1 (0.36) L3MBTL1KMT2AMEN1ALDH1A1BACE1
SCHEMBL20241993 0.74 ELOVL1 (0.42) L3MBTL1KMT2AMEN1ALDH1A1MPO
SCHEMBL20250029 0.73 CA12 (0.42) KMT2AMEN1KCNH2
SCHEMBL15090773 0.73 SCN9A (0.46) L3MBTL1STSKMT2AALDH1A1KAT6A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408767-B1 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS LUNDBECK & CO AS H (DK) 2013-07-10 EP claimed
WO-2010108052-A2 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS H. LUNDBECK A/S (DK) 2010-09-23 WO claimed
WO-2025121409-A1 NITROGEN-CONTAINING AROMATIC HETEROCYCLIC AND AROMATIC CARBOCYCLIC DERIVATIVE HAVING SEROTONIN RECEPTOR BINDING ACTIVITY シオノギ-アプニメッド スリープ サイエンス、エルエルシー 2025-06-12 WO disclosed
US-20180251431-A1 1,3-SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACID LEVELS VERTEX PHARMACEUTICALS INCORPORATED 2018-09-06 US disclosed
WO-2018107056-A1 1,3-SUBSTITUED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACIC LEVELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-06-14 WO disclosed
WO-2018107056-A1 1,3-SUBSTITUED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACIC LEVELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2018-06-14 WO disclosed
CN-103339129-B Azaindazole or diazaindazole derivatives as medicaments PIERRE FABRE MEDICAMENT (FR) 2015-07-29 CN disclosed
CN-104684554-A Derivatives of azaindazole or diazaindazole type for treating pain PF MEDICAMENT 2015-06-03 CN disclosed
CN-103339129-A Azaindazole or diazaindazole derivatives as medicaments PF MEDICAMENT 2013-10-02 CN disclosed
EP-2408767-B1 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS LUNDBECK & CO AS H (DK) 2013-07-10 EP disclosed
EP-2408767-B1 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS LUNDBECK & CO AS H (DK) 2013-07-10 EP disclosed
EP-2408767-A2 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS H. Lundbeck A/S (DK) 2012-01-25 EP disclosed
US-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2011-09-22 US disclosed
EP-2352730-A2 BIOLOGICALLY ACTIVE AMIDES H. Lundbeck A/S (DK) 2011-08-10 EP disclosed
WO-2010108052-A2 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS H. LUNDBECK A/S (DK) 2010-09-23 WO disclosed
WO-2010108052-A2 AMIDE DERIVATIVES AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS H. LUNDBECK A/S (DK) 2010-09-23 WO disclosed
WO-2010053861-A2 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2010-05-14 WO disclosed
US-20060014815-A1 Process for making pyrazole compounds MSD K.K. (JP) 2006-01-19 US disclosed
EP-1554251-A1 PROCESS FOR MAKING PYRAZOLE COMPOUNDS BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
WO-2004037794-A1 PROCESS FOR MAKING PYRAZOLE COMPOUNDS BANYU PHARMACEUTICAL CO., LTD (JP) 2004-05-06 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 (3 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-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES NPY5R, NPY1R, NPY2R L3MBTL1 4398/4885STS 1879/4885KMT2A 3489/4885
US-20060014815-A1 Process for making pyrazole compounds CYP3A5, CYP1B1, CYP3A4 L3MBTL1 4721/4885STS 399/4885KMT2A 3748/4885
US-20180251431-A1 1,3-SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACID LEVELS HSD17B4, CPT1A, ADH1A L3MBTL1 1581/4885STS 765/4885KMT2A 2360/4885

“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.