SCHEMBL12480489

SCHEMBL12480489

Nc1cccc(-c2c(F)cccc2F)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASIC3 Q9UHC3 1/20 0.52
NOS3 P29474 2/20 0.41
NOS2 P35228 1/20 0.41
BACE1 P56817 2/20 0.40
REV1 Q9UBZ9 1/20 0.40
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
IDH1 O75874 3/20 0.38
PDPK1 O15530 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
MAP4K1 Q92918 1/20 0.36
MPL P40238 1/20 0.36
TYK2 P29597 1/20 0.35
PTPN1 P18031 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL31262691 0.82 MAP4K1 (0.55) ASIC3NOS3MAP4K1NOS1
SCHEMBL30166486 0.79 MPL (0.55) ASIC3NOS3NOS2BACE1ALOX5AP
SCHEMBL3935260 0.79 MPL (0.55) ASIC3NOS3NOS2BACE1ALOX5AP
SCHEMBL29601960 0.78 ASIC3 (0.68) ASIC3NOS3NOS2BACE1IDH1
SCHEMBL1073895 0.78 ASIC3 (0.68) ASIC3NOS3NOS2BACE1IDH1
SCHEMBL3925102 0.78 ASIC3 (0.47) ASIC3NOS3NOS2BACE1REV1
SCHEMBL30883058 0.78 ASIC3 (0.47) ASIC3NOS3NOS2BACE1REV1
SCHEMBL29899251 0.76 NOS3 (0.54) ASIC3NOS3NOS2IDH1PDPK1
SCHEMBL18807016 0.74 CCR1 (0.62) NOS3NOS2IDH1F2RL3
SCHEMBL28513246 0.74 HSP90AA1 (0.53) FEN1SMN1; SMN2KDM4EMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2661433-B1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2017-08-16 EP disclosed
EP-2661433-B1 INDOLE COMPOUNDS OR ANALOGUES THEREOF USEFUL FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION (AMD) NOVARTIS AG (CH) 2017-08-16 EP disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 US disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 US disclosed
US-9085555-B2 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2015-07-21 US disclosed
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
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US disclosed
US-20120295884-A1 Complement pathway modulators and uses thereof NOVARTIS AG (CH) 2012-11-22 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120295884-A1 Complement pathway modulators and uses thereof C5, C3AR1, C9 ASIC3 2821/4885NOS3 3217/4885NOS2 3278/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.