SCHEMBL26383335

SCHEMBL26383335

CC(C)c1ccc(F)cc1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 3/20 0.39
▸ AKR1C3 P42330 3/20 0.38
▸ AKR1C2 P52895 3/20 0.38
▸ TDP1 Q9NUW8 1/20 0.35
▸ GPR55 Q9Y2T6 1/20 0.35
▸ CTSA P10619 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ AKR1C1 Q04828 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ HSP90AB1 P08238 1/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ KCNA5 P22460 1/20 0.34
▸ CETP P11597 1/20 0.34
▸ PTGS1 P23219 1/20 0.33
▸ PTGS2 P35354 1/20 0.33
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33
▸ APH1B Q8WW43 1/20 0.33
▸ NCSTN Q92542 1/20 0.33
▸ APH1A Q96BI3 1/20 0.33

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
SCHEMBL26382500 0.91 NOTUM (0.36) PDE2AAKR1C3AKR1C2GPR55CTSA
SCHEMBL10094438 0.87 AKR1C3 (0.43) PDE2AAKR1C3AKR1C2HSP90AA1HSP90AB1
SCHEMBL24910237 0.86 PDE2A (0.45) PDE2AAKR1C3AKR1C2HSP90AA1HSP90AB1
SCHEMBL10094415 0.86 KCNA5 (0.47) PDE2AAKR1C3AKR1C2TDP1KCNH2
SCHEMBL26383441 0.80 PDE2A (0.46) PDE2AAKR1C3AKR1C2RPS6KA3HSP90AA1
SCHEMBL24910270 0.80 PDE2A (0.46) PDE2AAKR1C3AKR1C2HSP90AA1HSP90AB1
SCHEMBL10094417 0.78 ROCK2 (0.39) RPS6KA3HSP90AA1HSP90AB1PTGS1PTGS2
SCHEMBL26382530 0.78 PDE2A (0.41) PDE2AAKR1C3AKR1C2HSP90AA1HSP90AB1
SCHEMBL10094452 0.78 PDE2A (0.51) PDE2AAKR1C3AKR1C2
SCHEMBL26383340 0.77 RPS6KA3 (0.44) RPS6KA3HSP90AA1HSP90AB1PSEN1PSEN2

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-20230320121-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-10-05 — — US disclosed
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