SCHEMBL3875252

SCHEMBL3875252

Fc1ncccc1-c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.55
DHODH Q02127 4/20 0.49
CYP11B1 P15538 1/20 0.47
MAPT P10636 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
GLO1 Q04760 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CSNK1A1 P48729 1/20 0.39
CSNK1D P48730 1/20 0.39
GSK3B P49841 1/20 0.39
CSNK1G2 P78368 1/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
NOTUM Q6P988 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL3881160 0.83 CYP11B2 (0.50) CYP11B2DHODHCYP11B1MAPTMAOA
SCHEMBL31051044 0.81 DHODH (0.50) CYP11B2DHODHCYP11B1MAPTMAOA
SCHEMBL3876408 0.81 DHODH (0.50) CYP11B2DHODHCYP11B1MAPTMAOA
SCHEMBL3606828 0.80 RAB9A (0.60) CYP11B2MAPTPTGS2NOTUMCYP1A2
SCHEMBL24196449 0.80 CYP11B2 (0.47) CYP11B2DHODHCYP11B1MAPTMAOA
SCHEMBL22230844 0.80 CYP11B2 (0.47) CYP11B2DHODHCYP11B1MAPTMAOA
SCHEMBL12947927 0.80 DHODH (0.48) CYP11B2DHODHCYP11B1MAPTMAOA
SCHEMBL18255779 0.80 CYP11B2 (0.47) CYP11B2DHODHCYP11B1MAPTTDP1
SCHEMBL20371666 0.80 MKNK1 (0.57) DHODHTDP1GLO1PTGS1PTGS2
SCHEMBL972023 0.80 CYP11B2 (0.47) CYP11B2DHODHCYP11B1MAPTMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7488728-B2 Pyridinylmorpholine derivatives ELI LILLY AND COMPANY (US) 2009-02-10 US disclosed
US-20070105960-A1 Treatment of learning disabilities and motor skills disorder with norepinephrine reuptake inhibitors ELI LILLY AND COMPANY (US) 2007-05-10 US disclosed
US-20070032554-A1 Treatment of stuttering and other communication disorders with norepinephrine reuptake inhibitors ELILILLY AND COMPANY A CORPORATION 2007-02-08 US disclosed
US-20070015786-A1 Treatment of hot flashes, impulse control disorders and personality change due to a general medical condition ELI LILY AND COMPANY (US) 2007-01-18 US disclosed
EP-1729754-A2 SELECTIVE NOREPINEPHRINE REUPTAKE INHIBITORS FOR THE TREATMENT OF HOT FLASHES, IMPULSE CONTROL DISORDERS AND PERSONALITY CHANGE DUE TO A GENERAL MEDICAL CONDITION ELI LILLY AND COMPANY (US) 2006-12-13 EP disclosed
US-20060258654-A1 Pyridinylmorpholine derivatives ELI LILLY AND COMPANY 2006-11-16 US disclosed
US-20060241188-A1 Treatment of pervasive developemental disorders with norepinephrine reuptake inhibitors ELILILLY AND COMPANY (US) 2006-10-26 US disclosed
EP-1660185-A2 TREATMENT OF STUTTERING AND OTHER COMMUNICATION DISORDERS WITH NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-05-31 EP disclosed
EP-1660064-A2 TREATMENT OF LEARNING DISABILITIES AND MOTOR SKILLS DISORDER WITH NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-05-31 EP disclosed
EP-1660065-A2 TREATMENT OF PERVASIVE DEVELOPMENTAL DISORDERS WITH NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2006-05-31 EP disclosed
EP-1658287-A1 PYRIDINYLMORPHOLINE DERIVATIVES ELI LILLY AND COMPANY (US) 2006-05-24 EP disclosed
WO-2005060949-A2 SELECTIVE NOREPINEPHRINE REUPTAKE INHIBITORS FOR THE TREATMENT OF HOT FLASHES, IMPULSE CONTROL DISORDERS AND PERSONALITY CHANGE DUE TO A GENERAL MEDICAL CONDITION ELI LILLY AND COMPANY (US) 2005-07-07 WO disclosed
WO-2005053663-A2 NOREPINEPHRINE REUPTAKE INHIBITORS USEFUL FOR TREATMENT OF COGNITIVE FAILURE ELI LILLY AND COMPANY (US) 2005-06-16 WO disclosed
WO-2005023802-A1 PYRIDINYLMORPHOLINE DERIVATIVES ELI LILLY AND COMPANY (US) 2005-03-17 WO disclosed
WO-2005020976-A2 TREATMENT OF PERVASIVE DEVELOPMENTAL DISORDERS WITH NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-03-10 WO disclosed
WO-2005020975-A2 TREATMENT OF LEARNING DISABILITIES AND MOTOR SKILLS DISORDER WITH NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-03-10 WO disclosed
WO-2005021095-A2 TREATMENT OF STUTTERING AND OTHER COMMUNICATION DISORDERS WITH NOREPINEPHRINE REUPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 2005-03-10 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 (5 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-20060241188-A1 Treatment of pervasive developemental disorders with norepinephrine reuptake inhibitors SLC6A2, SLC6A3, SLC6A4 CYP11B2 823/4885DHODH 495/4885CYP11B1 1121/4885
US-20070105960-A1 Treatment of learning disabilities and motor skills disorder with norepinephrine reuptake inhibitors SLC6A2, SLC6A3, SLC6A4 CYP11B2 2864/4885DHODH 691/4885CYP11B1 3116/4885
US-20070032554-A1 Treatment of stuttering and other communication disorders with norepinephrine reuptake inhibitors SLC6A2, SLC6A4, SLC6A3 CYP11B2 2124/4885DHODH 1383/4885CYP11B1 2476/4885
US-20070015786-A1 Treatment of hot flashes, impulse control disorders and personality change due to a general medical condition SLC6A2, SLC6A4, HTR5A CYP11B2 1024/4885DHODH 1529/4885CYP11B1 1459/4885
US-20060258654-A1 Pyridinylmorpholine derivatives OPRM1, OPRK1, CHRM1 CYP11B2 314/4885DHODH 2634/4885CYP11B1 444/4885

“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.