SCHEMBL31066871

SCHEMBL31066871

CCCCCCCCCCCCCNc1ccncc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.53
ABL1 P00519 1/20 0.47
LATS1 O95835 1/20 0.46
LATS2 Q9NRM7 1/20 0.46
KCNH3 Q9ULD8 2/20 0.45
ACHE P22303 4/20 0.42
S1PR2 O95136 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM6B O15054 1/20 0.41
KDM4C Q9H3R0 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
DNM2 P50570 2/20 0.41

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
SCHEMBL11470330 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL863456 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL2262258 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL11470674 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL11477556 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL25383583 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL11487106 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL11470551 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
SCHEMBL11470387 1.00 NAAA (0.53) NAAAABL1LATS1LATS2KCNH3
Hydrochloric Acid SCHEMBL16294823 0.98 NAAA (0.51) NAAAABL1LATS1LATS2KCNH3

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-2024181373-A1 METHOD FOR SELECTIVELY MODIFYING SUBSTRATE SURFACE, METHOD FOR PRODUCING SURFACE-TREATED SUBSTRATE, AND COMPOSITION JSR株式会社 2024-09-06 WO disclosed