SCHEMBL1151874

SCHEMBL1151874

CCCCCN1CC[C@H](c2ccc(F)cc2)[C@@H](COc2ccc3c(c2)OCO3)C1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.63
HTR1A P08908 5/20 0.60
CYP3A4 P08684 4/20 0.58
TP53 P04637 2/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2D6 P10635 2/20 0.58
GRK2 P25098 2/20 0.58
ALDH1A1 P00352 1/20 0.58
CYP2C9 P11712 1/20 0.58
HSD17B10 Q99714 1/20 0.58
NPC1 O15118 1/20 0.58
CACNA1F O60840 1/20 0.58
MPO P05164 1/20 0.58
ADRB2 P07550 1/20 0.58
CHRM2 P08172 1/20 0.58
CHRM4 P08173 1/20 0.58
ABCB1 P08183 1/20 0.58
CHRM5 P08912 1/20 0.58
ADORA3 P0DMS8 1/20 0.58
CHRM1 P11229 1/20 0.58

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
SCHEMBL1151876 1.00 L3MBTL1 (0.63) L3MBTL1HTR1ACYP3A4TP53CYP1A2
Hydrochloric Acid SCHEMBL1152714 0.99 L3MBTL1 (0.62) L3MBTL1HTR1ACYP3A4TP53CYP1A2
Hydrochloric Acid SCHEMBL9397546 0.99 L3MBTL1 (0.62) L3MBTL1HTR1ACYP3A4TP53CYP1A2
Hydrochloric Acid SCHEMBL9397533 0.99 L3MBTL1 (0.62) L3MBTL1HTR1ACYP3A4TP53CYP1A2
Hydrochloric Acid SCHEMBL1152712 0.99 L3MBTL1 (0.62) L3MBTL1HTR1ACYP3A4TP53CYP1A2
SCHEMBL5080341 0.99 L3MBTL1 (0.62) L3MBTL1HTR1ACYP3A4TP53CYP1A2
SCHEMBL5080346 0.99 L3MBTL1 (0.62) L3MBTL1HTR1ACYP3A4TP53CYP1A2
Hydrochloric Acid SCHEMBL9397656 0.98 L3MBTL1 (0.61) L3MBTL1HTR1ACYP3A4TP53CYP1A2
Hydrochloric Acid SCHEMBL5079381 0.98 L3MBTL1 (0.61) L3MBTL1HTR1ACYP3A4TP53CYP1A2
Hydrochloric Acid SCHEMBL9397472 0.98 L3MBTL1 (0.61) L3MBTL1HTR1ACYP3A4TP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0266574-B1 Piperidine compounds and their preparation and use NOVO NORDISK AS (DK) 1994-01-05 EP claimed
US-5019582-A Preventing Calcium Overload In Brain Cells NOVO NORDISK A/S (DK) 1991-05-28 US claimed
US-20130289024-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES U.S. ARMY MEDICAL RESEARCH AND MATERIEL COMMAND 2013-10-31 US disclosed
US-8475804-B2 Compositions and methods for treatment of filovirus-mediated diseases U.S. ARMY MEDICAL RESEARCH AND MATERIAL COMMAND (US) 2013-07-02 US disclosed
US-20110028564-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES ZALICUS INC. 2011-02-03 US disclosed
EP-0339579-B1 Piperidine compositions and their preparation and use NOVO NORDISK AS (DK) 1998-07-15 EP disclosed
US-5227379-A 1-Heterocycyl-4-phenyl substituted, calcium-channel antagonists NOVO NORDISK A/S (DK) 1993-07-13 US disclosed
US-5208232-A Anoxia, migraine; antiepileptic and antiischemic agents NOVO NORDISK A/S (DK) 1993-05-04 US disclosed
US-5158961-A Treatment of anoxia, migraine, ischemica and epilepsy NOVO NORDISK A/S (DK) 1992-10-27 US disclosed
US-5017585-A Piperidine compounds NOVO NORDISK A/S (DK) 1991-05-21 US disclosed
EP-0374675-A2 Reduction of piperidine-dion-derivatives and intermediates NOVO NORDISK A/S (DK) 1990-06-27 EP disclosed
EP-0374674-A2 Etherification and dealkylation of piperidine derivatives and intermediates A/S FERROSAN (DK) 1990-06-27 EP disclosed
EP-0339579-A2 Piperidine compositions and their preparation and use NOVO NORDISK A/S (DK) 1989-11-02 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 (2 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-20110028564-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES FLNA, FLNB, PIGS L3MBTL1 1417/4885HTR1A 4623/4885CYP3A4 4074/4885
US-20130289024-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF FILOVIRUS-MEDIATED DISEASES FLNA, FLNB, PIGS L3MBTL1 1417/4885HTR1A 4623/4885CYP3A4 4074/4885

“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.