SCHEMBL9720787

SCHEMBL9720787

OCc1cccc(-c2cccc(F)c2)c1-c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.42
TAAR1 Q96RJ0 3/20 0.40
PDCD1 Q15116 3/20 0.40
CD274 Q9NZQ7 3/20 0.40
DCLRE1B Q9H816 1/20 0.38
CDC7 O00311 2/20 0.38
PIM1 P11309 2/20 0.38
GSK3B P49841 2/20 0.38
HIPK2 Q9H2X6 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
PDK2 Q15119 3/20 0.38
ENPP1 P22413 1/20 0.38
FYN P06241 1/20 0.36
CDK4 P11802 1/20 0.36
CCND1 P24385 1/20 0.36
CYP17A1 P05093 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
ROCK2 O75116 1/20 0.35

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
SCHEMBL9720784 0.95 ESR2 (0.43) ESR2TAAR1PDCD1CD274DCLRE1B
SCHEMBL9720773 0.92 PDCD1 (0.43) ESR2TAAR1PDCD1CD274DCLRE1B
SCHEMBL1443992 0.90 PDCD1 (0.43) PDCD1CD274GSK3BCLK4PDK2
SCHEMBL9720776 0.84 TAAR1 (0.40) ESR2TAAR1DCLRE1BCDC7PIM1
SCHEMBL9720789 0.83 PDCD1 (0.42) ESR2TAAR1PDCD1CD274DCLRE1B
SCHEMBL9720771 0.81 TAAR1 (0.40) ESR2TAAR1DCLRE1BCDC7PIM1
SCHEMBL18621557 0.80 PDCD1 (0.44) ESR2TAAR1PDCD1CD274DCLRE1B
SCHEMBL9720792 0.80 PDCD1 (0.42) ESR2TAAR1PDCD1CD274DCLRE1B
SCHEMBL9720758 0.79 PDCD1 (0.41) PDCD1CD274PDK2ENPP1CYP3A4
SCHEMBL9720754 0.78 PDCD1 (0.42) PDCD1CD274PDK2ENPP1

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