SCHEMBL9720754

SCHEMBL9720754

OCc1cccc(-c2ccc(F)cc2)c1-c1ccccc1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.42
CD274 Q9NZQ7 1/20 0.42
PDK2 Q15119 2/20 0.42
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
DHODH Q02127 1/20 0.39
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
KCNN4 O15554 1/20 0.37
GRM2 Q14416 1/20 0.37
PTGS2 P35354 2/20 0.37
NR4A2 P43354 1/20 0.37
PTGS1 P23219 1/20 0.37
FFAR1 O14842 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
ENPP1 P22413 1/20 0.36
LMNA P02545 1/20 0.36
RAB9A P51151 1/20 0.36
PRKAA2 P54646 1/20 0.36

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
SCHEMBL9720758 0.89 PDCD1 (0.41) PDCD1CD274PDK2ALDH1A1MAPT
SCHEMBL1443992 0.86 PDCD1 (0.43) PDCD1CD274PDK2SLC6A4SLC6A3
SCHEMBL9720789 0.86 PDCD1 (0.42) PDCD1CD274PDK2ALDH1A1MAPT
SCHEMBL9720768 0.85 ALDH1A1 (0.36) ALDH1A1MAPTL3MBTL1DHODHSLC6A4
SCHEMBL27555128 0.82 TTR (0.43) PDCD1CD274PDK2ALDH1A1L3MBTL1
SCHEMBL1041243 0.80 PDK2 (0.49) PDCD1CD274PDK2SLC6A4SLC6A3
SCHEMBL9720784 0.79 ESR2 (0.43) PDCD1CD274PDK2ENPP1
SCHEMBL9720787 0.78 ESR2 (0.42) PDCD1CD274PDK2ENPP1
SCHEMBL13824010 0.77 NR4A2 (0.48) PDCD1CD274PDK2SLC6A4SLC6A3
SCHEMBL9720792 0.76 PDCD1 (0.42) PDCD1CD274PDK2ALDH1A1MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5149707-A 1-((2-FLUOROPHENYL)(4-FLUOROPHENYL)PHENYLMETHYL)-1H-IMIDAZOLE USEFUL AS ANTIFUNGAL AGENT J. URIACH & CIA, S.A. (ES) 1992-09-22 US disclosed
EP-0352352-B1 1-[(2-Fluorophenyl)(4-fluorophenyl)phenylmethyl]-1H-imidazole J. URIACH & CIA. S.A. (ES) 1991-10-16 EP disclosed
EP-0352352-A1 1-[(2-Fluorophenyl)(4-fluorophenyl)phenylmethyl]-1H-imidazole J. URIACH & CIA. S.A. (ES) 1990-01-31 EP disclosed