SCHEMBL23308237

SCHEMBL23308237

c1ccc(-c2ccc3c4ccccc4n(-c4nc(-c5ccccc5)nc(-c5cccc(-c6ccccc6N(c6ccccc6)c6ccccc6)c5)n4)c3c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.33
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
PDE5A O76074 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
SCHEMBL23308280 0.96 ABCG2 (0.33) METAP2ABCG2PDE5A
SCHEMBL23308249 0.95 ABCG2 (0.32) METAP2ABCG2PDE5A
SCHEMBL23308310 0.95 ABCG2 (0.32) ABCG2PDE5A
SCHEMBL23308318 0.95 METAP2 (0.33) METAP2RXRARXRBABCG2PDE5A
SCHEMBL23308213 0.95 ABCG2 (0.31) METAP2ABCG2PDE5A
SCHEMBL23308325 0.94 TSPO (0.36) ABCG2PDE5A
SCHEMBL23308331 0.94 ABCG2 (0.34) METAP2ABCG2PDE5A
SCHEMBL23308267 0.91 TSPO (0.32) METAP2RXRARXRBPDE5A
SCHEMBL23308294 0.91 DUSP3 (0.32) ABCG2PDE5A
SCHEMBL23308274 0.91 KDM4E (0.38) METAP2ABCG2PDE5A

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-20210126204-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2021-04-29 US disclosed