SCHEMBL7475318

SCHEMBL7475318

Nc1nccn1-c1ccccc1C(=O)c1ccc(F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 4/20 0.42
▸ F2 P00734 1/20 0.40
▸ F12 P00748 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ RAB9A P51151 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ NOD1 Q9Y239 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ CCR6 P51684 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ TLR9 Q9NR96 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ CDK5 Q00535 1/20 0.37
▸ CDK5R1 Q15078 1/20 0.37

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
SCHEMBL7471362 0.87 LTA4H (0.40) MAPK14F2F12LTA4HRAB9A
SCHEMBL7470949 0.86 KDM4E (0.49) MAPK14LTA4HKDM4ELMNAPOLB
SCHEMBL7474375 0.86 MAPK14 (0.43) MAPK14RAB9AKDM4ENPC1LMNA
SCHEMBL7471841 0.85 MAPK14 (0.44) MAPK14RAB9ANPC1LMNAPOLB
SCHEMBL7473148 0.85 MAPK14 (0.44) MAPK14RAB9ANPC1LMNAPOLB
SCHEMBL7471290 0.84 ALDH1A1 (0.41) MAPK14KDM4EALDH1A1ATMNPSR1
SCHEMBL7475041 0.81 F7 (0.42) F2F12RAB9ANPC1POLB
SCHEMBL7469629 0.78 KMT2A (0.44) RAB9AKDM4ENPC1LMNAALDH1A1
SCHEMBL7477253 0.78 KDM4E (0.49) MAPK14KDM4ELMNAPOLBALDH1A1
SCHEMBL7475152 0.78 MAPK14 (0.44) MAPK14RAB9AKDM4ENPC1POLB

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
EP-1077701-A4 ANTI-VIRAL COMPOUNDS LILLY CO ELI (US) 2002-03-20 — — EP disclosed
EP-1077701-A1 ANTI-VIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 2001-02-28 — — EP disclosed
WO-1999059587-A1 ANTI-VIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 1999-11-25 — — WO disclosed
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