SCHEMBL31458727

SCHEMBL31458727

COc1cc2nc3c(c(Cl)c2cc1OC)CCC3

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.69
▸ EHMT2 Q96KQ7 16/20 0.63
▸ APP P05067 1/20 0.57
▸ BCHE P06276 1/20 0.57
▸ TP53 P04637 1/20 0.53
▸ MAPT P10636 1/20 0.51

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
SCHEMBL20745564 1.00 ACHE (0.69) ACHEEHMT2APPBCHETP53
SCHEMBL20745971 0.97 ACHE (0.74) ACHEEHMT2APPBCHETP53
SCHEMBL20756932 0.95 ACHE (0.72) ACHEEHMT2APPBCHETP53
SCHEMBL25489634 0.91 ACHE (0.58) ACHEEHMT2APPBCHETP53
SCHEMBL20746217 0.91 EHMT2 (0.59) ACHEEHMT2APPBCHETP53
SCHEMBL30063960 0.90 ACHE (0.57) ACHEEHMT2APPBCHETP53
SCHEMBL25489623 0.90 ACHE (0.57) ACHEEHMT2APPBCHETP53
SCHEMBL20756358 0.90 EHMT2 (0.57) ACHEEHMT2APPBCHETP53
SCHEMBL20745998 0.90 ACHE (0.57) ACHEEHMT2APPBCHETP53
SCHEMBL20745712 0.89 ACHE (0.56) ACHEEHMT2APPBCHETP53

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-3668863-B1 TRICYCLIC COMPOUNDS AS HISTONE METHYL-TRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2025-03-19 — — EP disclosed
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