SCHEMBL4797349

SCHEMBL4797349

[N]c1nccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAU P00749 2/20 0.58
CYP2A6 P11509 2/20 0.58
F12 P00748 1/20 0.58
NCF1 P14598 1/20 0.58
NOS3 P29474 1/20 0.58
NOS1 P29475 1/20 0.58
NOS2 P35228 1/20 0.58
BACE1 P56817 1/20 0.58
PLG P00747 1/20 0.47
MAPT P10636 4/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TSHR P16473 2/20 0.46
TDP1 Q9NUW8 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CFTR P13569 1/20 0.46
GOPC Q9HD26 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
SCHEMBL29923403 0.77 PLAU (0.60) PLAUCYP2A6F12NCF1NOS3
SCHEMBL199273 0.77 PLAU (0.60) PLAUCYP2A6F12NCF1NOS3
SCHEMBL24663121 0.75 CYP2A6 (0.58) PLAUCYP2A6F12NCF1NOS3
SCHEMBL30522769 0.75 PLAU (0.58) PLAUCYP2A6F12NCF1NOS3
SCHEMBL70487 0.73 PLAU (0.56) PLAUCYP2A6F12NCF1NOS3
SCHEMBL1567649 0.73 PLAU (0.56) PLAUCYP2A6F12NCF1NOS3
SCHEMBL1741872 0.73 PLAU (0.56) PLAUCYP2A6F12NCF1NOS3
SCHEMBL1010668 0.73 PLAU (0.56) PLAUCYP2A6F12NCF1NOS3
SCHEMBL58112 0.73 PLAU (0.56) PLAUCYP2A6F12NCF1NOS3
SCHEMBL3675858 0.73 PLAU (0.56) PLAUCYP2A6F12NCF1NOS3

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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220047602-A1 SELECTIVE GLUCOCORTICOID RECEPTOR MODIFIERS FOR TREATING IMPAIRED SKIN WOUND HEALING AKRIBES BIOMEDICAL GMBH (AT) 2022-02-17 US disclosed
EP-3914249-A1 SELECTIVE GLUCOCORTICOID RECEPTOR MODIFIERS FOR TREATING IMPAIRED SKIN WOUND HEALING Akribes Biomedical GmbH (AT) 2021-12-01 EP disclosed
CN-113382730-A Selective glucocorticoid receptor modifiers for treatment of impaired skin wound healing 阿克里斯生物医药有限公司 2021-09-10 CN disclosed
WO-2020152193-A1 SELECTIVE GLUCOCORTICOID RECEPTOR MODIFIERS FOR TREATING IMPAIRED SKIN WOUND HEALING AKRIBES BIOMEDICAL GMBH (AT) 2020-07-30 WO disclosed
US-7417056-B2 5-substituted quinoline and isoquinoline derivatives, a process for their production and their use as anti-inflammatory agents SCHERING AG (DE) 2008-08-26 US disclosed
US-7329753-B2 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors SCHERING AG (DE) 2008-02-12 US disclosed
US-7314879-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2008-01-01 US disclosed
US-7291619-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-11-06 US disclosed
US-7186715-B2 Piperazine- and piperidine-derivatives as melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-03-06 US disclosed
US-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US disclosed
EP-1358163-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2003-11-05 EP disclosed
WO-2003061660-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2003-07-31 WO disclosed
WO-2002059107-A1 SUBSTITUTED PIPERIDINES/PIPERAZINES AS MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 WO disclosed
WO-2002059095-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 WO disclosed
WO-2002059117-A1 PIPERAZINE- AND PIPERIDINE-DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 WO disclosed
WO-2002059108-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 WO disclosed
EP-0151319-B1 Hexahydrobenzo[de]quinoline derivatives and their preparation ELI LILLY AND COMPANY (US) 1988-04-20 EP disclosed
EP-0061341-B1 6-SUBSTITUTED HEXAHYDROINDAZOLO ISOQUINOLINES ELI LILLY AND COMPANY (US) 1986-04-30 EP disclosed
EP-0151319-A1 Hexahydrobenzo[de]quinoline derivatives and their preparation ELI LILLY AND COMPANY (US) 1985-08-14 EP disclosed
EP-0061341-A2 6-Substituted hexahydroindazolo isoquinolines ELI LILLY AND COMPANY (US) 1982-09-29 EP 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-20220047602-A1 SELECTIVE GLUCOCORTICOID RECEPTOR MODIFIERS FOR TREATING IMPAIRED SKIN WOUND HEALING NR3C1, NR3C2, MC2R PLAU 2696/4885CYP2A6 2248/4885F12 3178/4885

“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.