SCHEMBL7032355

SCHEMBL7032355

Cc1ccc(NC(=O)[C@](N)(CCCCN)C(=O)c2cccc3cc(O)ccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.41
NPC1 O15118 4/20 0.41
DEGS1 O15121 1/20 0.37
KDR P35968 2/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
ESR1 P03372 1/20 0.36
ESRRG P62508 1/20 0.36
ESR2 Q92731 1/20 0.36
POLB P06746 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
KIF11 P52732 1/20 0.35
PLG P00747 2/20 0.35
KLK1 P06870 2/20 0.35
NLRP3 Q96P20 1/20 0.35
ALPL P05186 1/20 0.35
ALPI P09923 1/20 0.35
ALPG P10696 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
SCHEMBL6290435 0.81 EGFR (0.34) DEGS1KDRESR1ESR2PLG
SCHEMBL6290421 0.81 EGFR (0.34) DEGS1KDRESR1ESR2PLG
SCHEMBL7032353 0.74 FNTA (0.46) RAB9ANPC1DEGS1KDRPOLB
Trifluoroacetic Acid SCHEMBL6286326 0.74 NR1H4 (0.37) RAB9ANPC1DEGS1KMT2AMEN1
SCHEMBL7037687 0.72 CCR5 (0.39) NPC1MMP1MMP2MMP9ESRRG
Hydrochloric Acid SCHEMBL6290557 0.70 FLT3 (0.39) RAB9ANPC1
Hydrochloric Acid SCHEMBL7209538 0.69 BACE1 (0.40) MMP1MMP2MMP9PLGKLK1
Hydrochloric Acid SCHEMBL6290419 0.69 DHPS (0.43) RAB9ANPC1KMT2AMEN1CASP3
Trifluoroacetic Acid SCHEMBL7038495 0.69 TP53 (0.35) RAB9ANPC1KLK1NLRP3TP53
Trifluoroacetic Acid SCHEMBL6287884 0.66 KEAP1 (0.37) RAB9ANPC1POLBKMT2AMEN1

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-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP disclosed