SCHEMBL11991149

SCHEMBL11991149

O=P(c1ccc(F)cc1)(c1ccc(F)cc1)c1cnc2c(ccc3cc(P(=O)(c4ccc(F)cc4)c4ccc(F)cc4)cnc32)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 2/20 0.37
▸ CCR5 P51681 2/20 0.37
▸ CCR8 P51685 2/20 0.37
▸ TOP1 P11387 2/20 0.34
▸ MCHR1 Q99705 5/20 0.33
▸ HTR2C P28335 2/20 0.33
▸ ABCG2 Q9UNQ0 1/20 0.33
▸ UTRN P46939 3/20 0.33
▸ STAMBP O95630 1/20 0.33
▸ COPS5 Q92905 1/20 0.33
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2A6 P11509 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ SENP8 Q96LD8 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP6 Q9GZR1 1/20 0.31
▸ HTR2B P41595 1/20 0.31
▸ MAP4K4 O95819 1/20 0.31
▸ GRM4 Q14833 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
SCHEMBL11991115 0.82 CCR1 (0.39) CCR1CCR5CCR8L3MBTL1
SCHEMBL9927350 0.81 CYP1A2 (0.38) TOP1UTRNCYP1A2CYP2A6CASP3
SCHEMBL11991144 0.76 UTRN (0.33) TOP1UTRNCYP1A2CYP2A6HTR2B
SCHEMBL19342206 0.74 CCR1 (0.51) CCR1CCR5CCR8L3MBTL1GRM4
SCHEMBL9927352 0.74 CES2 (0.39) —
SCHEMBL11991137 0.74 NPC1 (0.40) CCR1CCR5CCR8
SCHEMBL779999 0.74 CES2 (0.39) —
SCHEMBL11991139 0.74 DAO (0.33) TOP1UTRNCYP1A2CYP2A6HTR2B
SCHEMBL13854089 0.72 PDGFRB (0.51) CCR1CCR5CCR8TOP1MAP4K4
SCHEMBL30601500 0.72 PDGFRB (0.51) CCR1CCR5CCR8TOP1MAP4K4

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-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 — — US disclosed
US-20120211082-A1 PHOTOELECTRIC CONVERSION DEVICE AND SOLAR CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-23 — — US disclosed
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