SCHEMBL12480873

SCHEMBL12480873

COc1ccc2c(c1)c(CC(=O)O)cn2C(N)=O

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 12/20 0.67
AKR1C2 P52895 7/20 0.67
PTGS1 P23219 2/20 0.67
AKR1C4 P17516 1/20 0.67
PLA2G2A P14555 2/20 0.56
MTNR1A P48039 1/20 0.52
HTR6 P50406 1/20 0.51
HSD17B10 Q99714 1/20 0.50
KDM4E B2RXH2 1/20 0.50
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
PPARA Q07869 1/20 0.46
AR P10275 1/20 0.46

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
SCHEMBL6944998 0.85 AKR1C3 (0.55) AKR1C3AKR1C2PTGS1AKR1C4PLA2G2A
SCHEMBL12480854 0.84 AKR1C3 (0.49) AKR1C3AKR1C2PTGS1AKR1C4PLA2G2A
SCHEMBL18133072 0.84 AKR1C3 (0.81) AKR1C3AKR1C2PTGS1AKR1C4HTR6
SCHEMBL2685182 0.82 MTNR1A (0.63) AKR1C3AKR1C2PTGS1AKR1C4PLA2G2A
SCHEMBL14886624 0.82 AKR1C3 (0.81) AKR1C3AKR1C2PTGS1AKR1C4HTR6
SCHEMBL12286233 0.82 AKR1C3 (0.81) AKR1C3AKR1C2PTGS1AKR1C4HTR6
SCHEMBL8648200 0.82 AKR1C3 (0.61) AKR1C3AKR1C2PTGS1AKR1C4PLA2G2A
SCHEMBL2694527 0.81 AKR1C3 (1.00) AKR1C3AKR1C2PTGS1AKR1C4AR
Methane SCHEMBL11569107 0.80 AKR1C3 (0.98) AKR1C3AKR1C2PTGS1AKR1C4AR
SCHEMBL12479971 0.80 AKR1C3 (0.65) AKR1C3AKR1C2PTGS1AKR1C4HTR6

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 AKR1C3 54/4885AKR1C2 698/4885PTGS1 745/4885

“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.