SCHEMBL27263103

SCHEMBL27263103

Clc1ncc(Cl)c(-c2ccc(Cl)c(-c3ccccc3)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 2/20 0.46
ADORA1 P30542 4/20 0.43
MAP4K4 O95819 1/20 0.41
CYP2A6 P11509 1/20 0.40
RPS6KA5 O75582 1/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
ADORA2A P29274 4/20 0.39
USP7 Q93009 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL30919680 1.00 BTK (0.46) BTKADORA1MAP4K4CYP2A6RPS6KA5
SCHEMBL27264188 0.88 ADORA1 (0.43) BTKADORA1MAP4K4CYP2A6RPS6KA5
SCHEMBL30919849 0.88 ADORA1 (0.43) BTKADORA1MAP4K4CYP2A6RPS6KA5
SCHEMBL27263191 0.87 BTK (0.43) BTKADORA1MAP4K4RPS6KA5LMNA
SCHEMBL30919676 0.87 BTK (0.43) BTKADORA1MAP4K4RPS6KA5LMNA
SCHEMBL30919634 0.83 ADORA1 (0.50) BTKADORA1LMNAALDH1A1SMN1; SMN2
SCHEMBL30444276 0.83 KDM4E (0.55) BTKADORA1RPS6KA5LMNAALDH1A1
SCHEMBL25820968 0.83 KDM4E (0.55) BTKADORA1RPS6KA5LMNAALDH1A1
SCHEMBL29967741 0.82 BTK (0.52) BTKADORA1RPS6KA5LMNAALDH1A1
SCHEMBL30919617 0.82 BTK (0.52) BTKADORA1RPS6KA5LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024107746-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES (US) 2024-05-23 WO disclosed