SCHEMBL7472140

SCHEMBL7472140

Fc1ccccc1C=Cc1nc2ccccc2n1-c1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
KMT2A Q03164 1/20 0.47
TP53 P04637 3/20 0.46
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
PKM P14618 1/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NFE2L2 Q16236 3/20 0.41
GRM4 Q14833 1/20 0.40
POLB P06746 1/20 0.38

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
SCHEMBL7472130 1.00 LMNA (0.47) LMNAKMT2ATP53MAPTKDM4E
Hydrochloric Acid SCHEMBL6836957 0.99 LMNA (0.46) LMNAKMT2ATP53MAPTKDM4E
Hydrochloric Acid SCHEMBL6836953 0.99 LMNA (0.46) LMNAKMT2ATP53MAPTKDM4E
Hydrochloric Acid SCHEMBL6844604 0.88 NFE2L2 (0.43) LMNAKMT2ATP53MAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL6836865 0.88 NFE2L2 (0.43) LMNAKMT2ATP53MAPTSMN1; SMN2
SCHEMBL7473227 0.87 RAB9A (0.42) LMNAKMT2ATP53MAPTKDM4E
SCHEMBL7473215 0.87 RAB9A (0.42) LMNAKMT2ATP53MAPTKDM4E
Hydrochloric Acid SCHEMBL6836924 0.86 RAB9A (0.41) LMNAKMT2ATP53MAPTKDM4E
Hydrochloric Acid SCHEMBL6839856 0.86 RAB9A (0.41) LMNAKMT2ATP53MAPTKDM4E
Hydrochloric Acid SCHEMBL6832793 0.84 KMT2A (0.44) LMNAKMT2ATP53MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937722-B1 Benzimidazole derivatives as cyclooxygenase-2 inhibitors PFIZER (US) 2002-07-03 EP claimed