SCHEMBL26383666

SCHEMBL26383666

CC(C)c1cc(F)c(C(F)(F)F)cc1-c1cc(C#N)cc(C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.40
▸ RXRA P19793 1/20 0.38
▸ RXRG P48443 1/20 0.38
▸ XDH P47989 1/20 0.37
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ AR P10275 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ METAP2 P50579 1/20 0.32
▸ PSEN1 P49768 1/20 0.31
▸ PSEN2 P49810 1/20 0.31
▸ APH1B Q8WW43 1/20 0.31
▸ NCSTN Q92542 1/20 0.31
▸ APH1A Q96BI3 1/20 0.31
▸ PSENEN Q9NZ42 1/20 0.31
▸ CETP P11597 1/20 0.31
▸ CYP11B1 P15538 1/20 0.30
▸ CYP11B2 P19099 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP3A5 P20815 1/20 0.30
▸ AKR1C3 P42330 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
SCHEMBL26383665 0.86 AKR1C3 (0.37) KIF11CETPAKR1C3AKR1C2
SCHEMBL26382545 0.81 NOTUM (0.35) CYP11B1CYP11B2AKR1C3AKR1C2
SCHEMBL26383561 0.81 KIF11 (0.40) KIF11AR
SCHEMBL26383562 0.76 KIF11 (0.35) KIF11CYP11B1CYP11B2
SCHEMBL26382537 0.75 KIF11 (0.34) KIF11CYP11B1CYP11B2
SCHEMBL26382558 0.74 RXRA (0.38) KIF11RXRARXRGXDHPTGDR2
SCHEMBL24909762 0.72 RXRA (0.46) KIF11RXRARXRGXDHAR
SCHEMBL26382535 0.71 AKR1C3 (0.33) CYP11B1CYP11B2AKR1C3AKR1C2
SCHEMBL22822524 0.71 RXRA (0.44) KIF11RXRARXRGXDHPTGDR2
SCHEMBL18001988 0.70 RXRA (0.46) KIF11RXRARXRGXDHAR

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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