SCHEMBL20627486

SCHEMBL20627486

Cc1ccnc2c1N1C(=CN(C)C1C)c1cccc(C(C)C)c1-2

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ ANPEP P15144 1/20 0.30
▸ DPP4 P27487 1/20 0.30

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
SCHEMBL17168502 1.00 ALDH1A1 (0.31) ALDH1A1ALOX15TSHRANPEPDPP4
SCHEMBL17168501 0.84 — —
SCHEMBL17171318 0.77 PDK2 (0.30) —
SCHEMBL20307185 0.76 — —
SCHEMBL23638112 0.71 — —
SCHEMBL9891022 0.69 ALDH1A1 (0.36) ALDH1A1DPP4
SCHEMBL12083455 0.69 ALDH1A1 (0.36) ALDH1A1DPP4
SCHEMBL17168500 0.68 ALDH1A1 (0.31) ALDH1A1ALOX15TSHR
SCHEMBL17168507 0.66 PDK2 (0.31) —
SCHEMBL17169587 0.64 ALDH1A1 (0.39) ALDH1A1ALOX15TSHRDPP4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3424934-B1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORP (US) 2021-07-14 — — EP disclosed
EP-3424934-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2019-01-09 — — EP disclosed
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