SCHEMBL7715052

SCHEMBL7715052

O=C(c1ccc(F)cc1)c1ccc(C#Cc2cccc(C(=O)c3ccc(F)cc3)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALPG P10696 2/20 0.45
HPGD P15428 2/20 0.45
VNN1 O95497 1/20 0.45
CTSL P07711 2/20 0.45
CTSK P43235 1/20 0.45
LTA4H P09960 1/20 0.44
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
MMP12 P39900 1/20 0.44
MAPK14 Q16539 3/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
GRM5 P41594 2/20 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
SCHEMBL6545360 1.00 ATM (0.46) ATMTDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL7716078 0.97 ATM (0.48) ATMTDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL7716935 0.97 VNN1 (0.47) ATMTDP1L3MBTL1VNN1MMP2
SCHEMBL4301156 0.95 L3MBTL1 (0.53) ATMTDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL7518691 0.88 VNN1 (0.42) ATMTDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL7512194 0.88 GRM5 (0.42) ATMTDP1L3MBTL1LMNASMN1; SMN2
SCHEMBL1746493 0.86 MMP2 (0.55) LMNASMN1; SMN2ALPGHPGDLTA4H
SCHEMBL7717354 0.86 LTA4H (0.57) TDP1LMNASMN1; SMN2ALPGHPGD
SCHEMBL7716924 0.86 LTA4H (0.57) TDP1LMNASMN1; SMN2ALPGHPGD
SCHEMBL7715045 0.86 LTA4H (0.57) TDP1LMNASMN1; SMN2ALPGHPGD

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-6380347-B1 MACROCYCLES MADE BY THE CYCLIZATION OF A BISPHENOL CONTAINING TRIPLE BOND(S) AND A DIFLUOROAROMATIC COMPOUND; MODIFIERS OF CROSSLINKED POLYMERS; LOW DIELECTRIC CONSTANT FOR THE LAYERS OF INTEGRATED CIRCUITS CONTAINING METALLIC CONNECTORS HONEYWELL INTERNATIONAL INC. 2002-04-30 US claimed
US-6380347-B1 MACROCYCLES MADE BY THE CYCLIZATION OF A BISPHENOL CONTAINING TRIPLE BOND(S) AND A DIFLUOROAROMATIC COMPOUND; MODIFIERS OF CROSSLINKED POLYMERS; LOW DIELECTRIC CONSTANT FOR THE LAYERS OF INTEGRATED CIRCUITS CONTAINING METALLIC CONNECTORS HONEYWELL INTERNATIONAL INC. 2002-04-30 US disclosed