SCHEMBL29804248

SCHEMBL29804248

Cc1c(I)cnc(Cl)c1C#N

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 5/20 0.33
HTT P42858 2/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
GLA P06280 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
AR P10275 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
SCHEMBL23754190 1.00 ALDH1A1 (0.43) ALDH1A1L3MBTL1KDM4EHTTKMT2A
SCHEMBL2912781 0.80 ALDH1A1 (0.46) ALDH1A1L3MBTL1KDM4EHTTKMT2A
SCHEMBL846431 0.80 KMT2A (0.36) ALDH1A1KMT2AMEN1NPSR1TDP1
SCHEMBL8655458 0.77 ALDH1A1 (0.43) ALDH1A1KDM4EHTTTSHRHSD17B10
SCHEMBL3830239 0.77 ALDH1A1 (0.43) ALDH1A1L3MBTL1KDM4EHTTKMT2A
SCHEMBL23754325 0.77 TTR (0.36)
SCHEMBL18956948 0.77 KDM4E (0.36) ALDH1A1L3MBTL1KDM4EHTTKMT2A
SCHEMBL23776483 0.77 ALDH1A1 (0.32) ALDH1A1NPSR1TDP1
SCHEMBL22208226 0.77 ALDH1A1 (0.35) ALDH1A1L3MBTL1KDM4EHTTKMT2A
SCHEMBL30064854 0.77 ALDH1A1 (0.35) ALDH1A1L3MBTL1KDM4EHTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4304585-A2 METHYL-SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS, DERIVATIVES THEREOF, AND METHODS OF THEIR USE Latigo Biotherapeutics, Inc. (US) 2024-01-17 EP disclosed
WO-2022192487-A2 METHYL-SUBSTITUTED PYRIDINE AND PYRIDAZINE COMPOUNDS, DERIVATIVES THEREOF, AND METHODS OF THEIR USE LATIGO BIOTHERAPEUTICS, INC. (US) 2022-09-15 WO disclosed