SCHEMBL29330567

SCHEMBL29330567

N#Cc1cc(Oc2ccccc2)cc(Nc2ccc3cc[nH]c3c2)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 6/20 0.45
CSNK1A1 P48729 1/20 0.43
CSNK1D P48730 1/20 0.43
ESR1 P03372 2/20 0.38
TNK2 Q07912 1/20 0.38
MEN1 O00255 1/20 0.38
GLA P06280 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PRKCD Q05655 1/20 0.37
TTBK1 Q5TCY1 1/20 0.37
TTBK2 Q6IQ55 1/20 0.37
SYK P43405 2/20 0.37
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37
RHEB Q15382 1/20 0.36
RAF1 P04049 1/20 0.35
MAP2K1 Q02750 1/20 0.35

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
SCHEMBL29330161 0.91 ESR1 (0.48) PRKCQCSNK1A1CSNK1DESR1MEN1
SCHEMBL29330255 0.90 ESR1 (0.42) PRKCQESR1TTBK1TTBK2SYK
SCHEMBL29330425 0.90 ESR1 (0.42) PRKCQCSNK1A1CSNK1DESR1MEN1
SCHEMBL29330163 0.90 ESR1 (0.42) PRKCQESR1SMN1; SMN2TTBK1TTBK2
SCHEMBL29328747 0.89 EGFR (0.42) PRKCQCSNK1A1CSNK1DESR1TTBK1
SCHEMBL29329725 0.89 PRKCQ (0.40) PRKCQCSNK1A1CSNK1DESR1PRKCD
SCHEMBL29330251 0.88 SYK (0.41) PRKCQESR1MEN1POLBKMT2A
SCHEMBL29329642 0.87 ABL1 (0.46) PRKCQESR1TTBK1TTBK2SYK
SCHEMBL29330248 0.87 ESR1 (0.46) PRKCQESR1TTBK1TTBK2SYK
SCHEMBL29330032 0.87 SYK (0.42) PRKCQESR1MEN1POLBKMT2A

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-2024151919-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2024-07-18 WO disclosed