SCHEMBL31467708

SCHEMBL31467708

COc1cc2nncc(N)c2cc1OC[C@H]1CCN(C)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.51
▸ EHMT2 Q96KQ7 2/20 0.50
▸ KIT P10721 3/20 0.49
▸ SRC P12931 6/20 0.46
▸ ABL1 P00519 5/20 0.46
▸ ABL2 P42684 5/20 0.46
▸ EGFR P00533 9/20 0.45
▸ KDR P35968 6/20 0.45
▸ FGFR1 P11362 4/20 0.45
▸ FLT1 P17948 4/20 0.45
▸ FLT4 P35916 4/20 0.45
▸ EHMT1 Q9H9B1 1/20 0.44
▸ BMPR1B O00238 1/20 0.44
▸ PLK4 O00444 1/20 0.44
▸ CIT O14578 1/20 0.44
▸ GAK O14976 1/20 0.44
▸ EPHB6 O15197 1/20 0.44
▸ RIPK2 O43353 1/20 0.44
▸ ROCK2 O75116 1/20 0.44
▸ STK10 O94804 1/20 0.44

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
SCHEMBL31467707 0.87 EGFR (0.49) PDPK1EHMT2KITSRCABL1
SCHEMBL5245086 0.78 PDE10A (0.56) —
SCHEMBL8306125 0.75 EHMT2 (0.53) PDPK1EHMT2KITSRCABL1
SCHEMBL4417734 0.75 EGFR (0.61) PDPK1KITSRCABL1ABL2
SCHEMBL4687074 0.73 KDR (0.60) PDPK1KITSRCABL1ABL2
SCHEMBL19462030 0.72 EHMT2 (0.53) PDPK1EHMT2KITEGFRCHRM3
SCHEMBL19476946 0.72 EHMT2 (0.53) PDPK1EHMT2KITEGFRCHRM3
SCHEMBL19476947 0.72 EHMT2 (0.53) PDPK1EHMT2KITEGFRCHRM3
SCHEMBL30646062 0.71 EGFR (0.44) PDPK1KITEGFR
SCHEMBL20303993 0.71 KDR (0.50) PDPK1EHMT2KITSRCABL1

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-2025062157-A1 NEW TREATMENTS FOR PAIN SEVENLESS THERAPEUTICS LIMITED (GB) 2025-03-27 — — WO disclosed
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