SCHEMBL22754665

SCHEMBL22754665

CC1=C(N)C(C)(C)CC=C1Cn1c2c(c3ccccc31)C=CCC2

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 2/20 0.32
▸ CA1 P00915 3/20 0.30
▸ CA2 P00918 3/20 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
SCHEMBL21531573 0.72 HTR6 (0.37) HTR6CA1CA2
SCHEMBL26407841 0.71 KDM4E (0.47) CA1CA2
SCHEMBL21765759 0.71 CA1 (0.52) HTR6CA1CA2
SCHEMBL21387946 0.64 — —
SCHEMBL31434384 0.64 GPR3 (0.45) —
SCHEMBL14024612 0.64 GPR3 (0.45) —
SCHEMBL15149266 0.62 ALDH1A1 (0.55) —
SCHEMBL19784884 0.62 — —
SCHEMBL10073214 0.61 MAPT (0.39) —
SCHEMBL23586311 0.61 TSHR (0.38) —

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-3748708-A1 ORGANIC LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME Samsung Display Co., Ltd. (KR) 2020-12-09 — — EP disclosed
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