SCHEMBL22375349

SCHEMBL22375349

CCOOc1ccc(-c2c3nc(c(-c4ccc(OCCCCC(=O)OCC)cc4)c4ccc([nH]4)c(-c4ccc(OOCC)cc4)c4nc(c(-c5ccc(OCCCCC(=O)OCC)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.45
▸ PDE3A Q14432 2/20 0.45
▸ P2RY12 Q9H244 2/20 0.45
▸ ABCG2 Q9UNQ0 1/20 0.43
▸ CYSLTR2 Q9NS75 1/20 0.42
▸ CYSLTR1 Q9Y271 1/20 0.42
▸ TOP1 P11387 3/20 0.42
▸ CYCS P99999 4/20 0.41
▸ FFAR1 O14842 1/20 0.38
▸ ENPP2 Q13822 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ FAAH O00519 1/20 0.38
▸ ALDH2 P05091 1/20 0.38
▸ TERT O14746 1/20 0.38

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
SCHEMBL8907605 0.81 ABCG2 (0.52) PDE3BPDE3AP2RY12ABCG2TOP1
SCHEMBL13547830 0.80 PDE3B (0.48) PDE3BPDE3AP2RY12ABCG2CYSLTR2
SCHEMBL19718117 0.78 CYSLTR2 (0.47) PDE3BPDE3AP2RY12CYSLTR2CYSLTR1
SCHEMBL2531376 0.76 TERT (0.49) ABCG2TOP1CYCSENPP2TERT
SCHEMBL8031578 0.76 TERT (0.49) ABCG2TOP1CYCSENPP2TERT
SCHEMBL12190732 0.76 TERT (0.49) ABCG2TOP1CYCSENPP2TERT
SCHEMBL12633085 0.74 TERT (0.47) ABCG2TOP1CYCSENPP2TERT
SCHEMBL3554346 0.73 TOP1 (0.48) PDE3BPDE3AP2RY12ABCG2TOP1
SCHEMBL586280 0.73 NR5A1 (0.57) ABCG2TOP1CYCSENPP2LTA4H
SCHEMBL588821 0.73 TERT (0.44) ABCG2TOP1CYCSENPP2TERT

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
US-10875983-B2 Photon upconversion film and method for producing the same WAKAYAMA PREFECTURE (JP) 2020-12-29 — — US disclosed
US-20200270419-A1 PHOTON UPCONVERSION FILM AND METHOD FOR PRODUCING THE SAME WAKAYAMA PREFECTURE (JP) 2020-08-27 — — US disclosed
Send feedback