SCHEMBL9407149

SCHEMBL9407149

O=C(c1ccc(F)cc1)c1cccc2c(C(=O)c3ccc(F)cc3)cccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
MAPT P10636 4/20 0.46
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
KMT2A Q03164 4/20 0.44
HTT P42858 3/20 0.44
MEN1 O00255 3/20 0.44
KDM4E B2RXH2 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
LMNA P02545 1/20 0.44
POLB P06746 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
HPGD P15428 2/20 0.43
NPC1 O15118 1/20 0.43
ALOX12 P18054 1/20 0.43

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
SCHEMBL27530446 0.92 MAPT (0.51) LTA4HCES2CES1MAPTCA1
SCHEMBL124290 0.89 PRNP (0.57) LTA4HCES2CES1MAPTKMT2A
SCHEMBL9654263 0.89 CDC25B (0.56) MAPTKMT2AHTTMEN1KDM4E
SCHEMBL10385522 0.85 MAPT (0.49) LTA4HCES2CES1MAPTKMT2A
SCHEMBL1754308 0.85 AKR1C3 (0.58) LTA4HCES2CES1MAPTCA1
Benzene SCHEMBL28318261 0.83 AKR1C3 (0.61) LTA4HCES2CES1MAPTKMT2A
SCHEMBL28134072 0.82 CYP1A2 (0.48) LTA4HMAPTKMT2AHTTMEN1
SCHEMBL27873928 0.81 AKR1C3 (0.65) LTA4HCES2CES1MAPTHTT
SCHEMBL9409888 0.81 PTPN1 (0.54) LTA4HKMT2AMEN1NPC1BAD
SCHEMBL717723 0.80 AKR1C3 (0.64) MAPTNPSR1POLBAKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5290906-A Polymers from hydroquinone and 2,6-bisUp-fluorobenzoyle naphthalene for films and fibers with tensile strength TEIJIN LIMITED (JP) 1994-03-01 US disclosed
US-5191056-A Molding materials TEIJIN LIMITED (JP) 1993-03-02 US disclosed
US-5037936-A Bis(acid chloride) terminated polyaryl ether ketone oligomer AMOCO CORPORATION (US) 1991-08-06 US disclosed
EP-0428743-A1 POLY(ARYLENE ETHER KETONE), METHOD OF ITS PRODUCTION, AND ITS USE TEIJIN LIMITED (JP) 1991-05-29 EP disclosed
US-4959423-A IMPROVED CRYSTALLIZATION RATES AMOCO CORPORATION (US) 1990-09-25 US disclosed
US-4910289-A Crystal structure; blend with poly(arylene sulfide) AMOCO CORPORATION (US) 1990-03-20 US disclosed
US-4861915-A Poly (aryl ether ketone) block copolymers AMOCO CORPORATION (US) 1989-08-29 US disclosed
US-4786694-A Poly(aryl ether ketone) block copolymers AMOCO CORPORATION (US) 1988-11-22 US disclosed