SCHEMBL20242011

SCHEMBL20242011

COc1cc(-n2ccc(N)n2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELOVL1 Q9BW60 1/20 0.43
LOX P28300 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
OPRM1 P35372 1/20 0.40
CACNA2D1 P54289 1/20 0.40
NOS3 P29474 2/20 0.39
NOS1 P29475 2/20 0.39
NOS2 P35228 2/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
SMARCA2 P51531 2/20 0.38
SMARCA4 P51532 2/20 0.38
CYP17A1 P05093 3/20 0.37
CYP2C9 P11712 2/20 0.35
NR1H2 P55055 2/20 0.35
NR1H3 Q13133 2/20 0.35
CYP2D6 P10635 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
DYRK1A Q13627 2/20 0.34

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
SCHEMBL15825472 0.84 ELOVL1 (0.43) ELOVL1LOXLOXL2OPRM1CACNA2D1
SCHEMBL15935032 0.83 ELOVL1 (0.44) ELOVL1LOXLOXL2OPRM1CACNA2D1
SCHEMBL20241614 0.81 NR1H2 (0.35) ELOVL1NR1H2NR1H3CHRM4
SCHEMBL20241939 0.80 ELOVL1 (0.43) ELOVL1NOS3NOS1NOS2KDM4E
SCHEMBL21888959 0.79 ELOVL1 (0.42) ELOVL1LOXLOXL2OPRM1CACNA2D1
SCHEMBL20242276 0.79 ELOVL1 (0.40) ELOVL1NOS3NOS1NOS2IRAK4
SCHEMBL23539580 0.78 LOX (0.42) ELOVL1LOXLOXL2OPRM1CACNA2D1
SCHEMBL20390801 0.76 CHRNB2 (0.41) OPRM1IRAK4MEN1KMT2A
SCHEMBL31316711 0.76 CHRNB2 (0.41) OPRM1IRAK4MEN1KMT2A
SCHEMBL20242190 0.76 ELOVL1 (0.42) ELOVL1LOXLOXL2OPRM1CACNA2D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743453-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION Pretzel Therapeutics, Inc. (US) 2026-05-20 EP disclosed
WO-2025015178-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2025-01-16 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20180251431-A1 1,3-SUBSTITUTED PYRAZOLE COMPOUNDS USEFUL FOR REDUCTION OF VERY LONG CHAIN FATTY ACID LEVELS HSD17B4, CPT1A, ADH1A ELOVL1 39/4885LOX 2604/4885LOXL2 2328/4885

“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.