SCHEMBL12479541

SCHEMBL12479541

O=C(NCc1cc(-c2nn[nH]n2)cc(Cl)c1F)C1CCCN1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 5/20 0.47
▸ HTR2C P28335 8/20 0.45
▸ GID4 Q8IVV7 1/20 0.42
▸ HTR2B P41595 5/20 0.42
▸ HTR2A P28223 4/20 0.42
▸ KDM4E B2RXH2 1/20 0.37
▸ FTO Q9C0B1 2/20 0.36
▸ XDH P47989 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36

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
SCHEMBL12480145 0.84 CFD (0.52) CFDFTOXDH
SCHEMBL19233827 0.79 HTR2C (0.49) CFDHTR2CGID4HTR2BHTR2A
SCHEMBL19234227 0.77 HTR2C (0.43) HTR2CGID4HTR2BHTR2AKDM4E
SCHEMBL19233453 0.76 GID4 (0.47) CFDHTR2CGID4HTR2BHTR2A
SCHEMBL12480127 0.74 CFD (0.44) CFDFTOXDH
SCHEMBL30052460 0.74 GID4 (0.55) CFDHTR2CGID4HTR2BHTR2A
SCHEMBL19210755 0.74 GID4 (0.55) CFDHTR2CGID4HTR2BHTR2A
SCHEMBL19233964 0.74 GID4 (0.55) CFDHTR2CGID4HTR2BHTR2A
SCHEMBL18116548 0.72 HTR2C (0.48) HTR2CHTR2BHTR2AKDM4E
SCHEMBL19234226 0.72 GID4 (0.43) HTR2CGID4HTR2BHTR2AKDM4E

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
EP-2661433-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) Novartis AG (CH) 2013-11-13 — — EP disclosed
WO-2012093101-A1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2012-07-12 — — WO disclosed
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