SCHEMBL30319370

SCHEMBL30319370

CC(=O)c1n[nH]c(=O)c2cc(F)ccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ PARP1 P09874 4/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ ALOX15 P16050 1/20 0.39
▸ HTT P42858 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ ALPL P05186 1/20 0.38
▸ ALPI P09923 1/20 0.38
▸ ALPG P10696 1/20 0.38
▸ MAP2K4 P45985 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ MAPK6 Q16659 1/20 0.38
▸ DAO P14920 1/20 0.38

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
SCHEMBL26071716 1.00 TSHR (0.42) TSHRKMT2APOLBCYP1A2SMN1; SMN2
SCHEMBL29875213 0.86 TSHR (0.39) TSHRKMT2APOLBCYP1A2SMN1; SMN2
SCHEMBL11165259 0.86 MAP2K4 (0.44) TSHRKMT2APOLBCYP1A2SMN1; SMN2
SCHEMBL30319377 0.82 KMT2A (0.38) TSHRKMT2APOLBCYP1A2SMN1; SMN2
SCHEMBL26071341 0.81 KMT2A (0.44) KMT2APOLBCYP1A2SMN1; SMN2KDM4E
SCHEMBL30319390 0.81 KMT2A (0.44) KMT2APOLBCYP1A2SMN1; SMN2KDM4E
SCHEMBL29874776 0.80 TSHR (0.39) TSHRKMT2APOLBCYP1A2SMN1; SMN2
SCHEMBL13995824 0.78 KDM4E (0.63) TSHRKMT2APOLBCYP1A2SMN1; SMN2
SCHEMBL30319401 0.78 KDM4E (0.63) TSHRKMT2APOLBCYP1A2SMN1; SMN2
SCHEMBL11163941 0.78 PARP1 (0.50) TSHRKMT2APOLBCYP1A2SMN1; SMN2

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
EP-4161905-A1 SUBSTITUTED (PHTHALAZIN-1-YLMETHYL)UREAS, SUBSTITUTED N-(PHTHALAZIN-1-YLMETHYL)AMIDES, AND ANALOGUES THEREOF Arbutus Biopharma Corporation (CA) 2023-04-12 — — EP disclosed
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