SCHEMBL25048024

SCHEMBL25048024

Nc1nc(Cl)nc2c1c(-c1nc(Cc3ccccc3)cs1)cn2C1CCC(C2CCNCC2)C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 11/20 0.35
▸ EGFR P00533 4/20 0.35
▸ LCK P06239 3/20 0.35
▸ TEK Q02763 2/20 0.35
▸ C1S P09871 1/20 0.35
▸ ABL1 P00519 3/20 0.33
▸ ABL2 P42684 3/20 0.33
▸ FGR P09769 1/20 0.32
▸ EPHA1 P21709 1/20 0.32
▸ TXK P42681 1/20 0.32
▸ FRK P42685 1/20 0.32
▸ PTK6 Q13882 1/20 0.32
▸ IGF1R P08069 2/20 0.31
▸ RIPK2 O43353 2/20 0.31
▸ CHKA P35790 1/20 0.31
▸ PRKD3 O94806 1/20 0.31
▸ PRKCG P05129 1/20 0.31
▸ PRKCB P05771 1/20 0.31
▸ PRKCA P17252 1/20 0.31
▸ PRKCH P24723 1/20 0.31

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
SCHEMBL25048727 0.91 SRC (0.35) SRCEGFRLCKC1SABL1
SCHEMBL25047567 0.89 C1S (0.36) SRCEGFRLCKTEKC1S
SCHEMBL25048943 0.88 C1S (0.35) SRCEGFRLCKC1SABL1
SCHEMBL25047541 0.88 SRC (0.49) SRCEGFRLCKTEKABL1
SCHEMBL25048047 0.87 C1S (0.33) SRCEGFRLCKC1SABL1
SCHEMBL25046690 0.86 ALK (0.34) SRCEGFRC1SGABRA1GABRB2
SCHEMBL25049217 0.85 C1S (0.36) SRCEGFRLCKTEKC1S
SCHEMBL25048023 0.84 C1S (0.33) SRCEGFRC1SGABRA1GABRB2
SCHEMBL30940839 0.84 C1S (0.33) SRCEGFRC1SGABRA1GABRB2
SCHEMBL25047579 0.84 EGFR (0.36) SRCEGFRLCKC1SABL1

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-2023017152-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2023-02-16 — — WO disclosed
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