SCHEMBL22202831

SCHEMBL22202831

Cc1cc(N(c2ccccc2)c2ccccc2)cc(C)c1-c1ccc2c(c1)C1(C)CCC2(C)CC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 2/20 0.32
▸ RARA P10276 1/20 0.32
▸ RARB P10826 1/20 0.32
▸ RARG P13631 1/20 0.32
▸ BRD4 O60885 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
SCHEMBL22202834 0.95 RARB (0.30) RXRARARBRARG
SCHEMBL22202837 0.86 RARB (0.45) RXRARARARARBRARG
SCHEMBL22202430 0.84 RARB (0.38) RXRARARARARBRARG
SCHEMBL22202784 0.84 PDK2 (0.36) RXRARARARARBRARG
SCHEMBL22202576 0.83 RARB (0.36) RXRARARARARBRARG
SCHEMBL22202660 0.83 BRD4 (0.31) BRD4
SCHEMBL22202810 0.82 RXRA (0.41) RXRARARARARBRARG
SCHEMBL22202803 0.82 — —
SCHEMBL22202817 0.81 RARB (0.40) RXRARARARARBRARG
SCHEMBL22202501 0.81 APP (0.32) RXRARARARARBRARG

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
US-20200216605-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-07-09 — — US disclosed
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