SCHEMBL8196238

SCHEMBL8196238

N[C@@H](Cc1cnc[nH]1)C(=O)OC(O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.52
▸ SLC7A5 Q01650 1/20 0.52
▸ DPP4 P27487 1/20 0.41
▸ HRH4 Q9H3N8 2/20 0.40
▸ HRH3 Q9Y5N1 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ THPO P40225 1/20 0.40

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
SCHEMBL20502169 1.00 CYP3A4 (0.52) CYP3A4SLC7A5DPP4HRH4HRH3
Hydrochloric Acid SCHEMBL20658884 0.99 CYP3A4 (0.51) CYP3A4SLC7A5HRH4HRH3ALDH1A1
SCHEMBL17223938 0.83 CYP3A4 (0.52) CYP3A4SLC7A5DPP4HRH4HRH3
SCHEMBL388562 0.77 CYP3A4 (0.73) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL15911724 0.77 CYP3A4 (0.63) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL163444 0.76 CYP3A4 (0.71) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL1537285 0.76 CYP3A4 (0.71) CYP3A4SLC7A5HRH4HRH3MEN1
Hydrochloric Acid SCHEMBL28268597 0.76 CYP3A4 (0.61) CYP3A4SLC7A5HRH4HRH3MEN1
Hydrochloric Acid SCHEMBL28331180 0.75 CYP3A4 (0.69) CYP3A4SLC7A5HRH4HRH3MEN1
SCHEMBL3435176 0.75 CYP3A4 (0.69) CYP3A4SLC7A5HRH4HRH3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023126947-A1 DETERMINATION OF THE TRAPPED VOLUME OF A LIPOSOME MOEBIUS MEDICAL LTD. (IL) 2023-07-06 — — WO disclosed
CN-114727960-A Liposomal cannabinoids and uses thereof 耶路撒冷希伯来大学伊森姆研究发展有限公司 2022-07-08 — — CN disclosed
US-20140154308-A1 Microparticle Formulations for Delivery to the Upper and Central Respiratory Tract and Methods of Manufacture ANSUN BIOPHARMA, INC. 2014-06-05 — — US disclosed
EP-2658572-A1 FLUOROCARBON-LINKED PEPTIDE FORMULATION Immune Targeting Systems (ITS) Limited (GB) 2013-11-06 — — EP disclosed
WO-2012090002-A1 FLUOROCARBON-LINKED PEPTIDE FORMULATION IMMUNE TARGETING SYSTEMS (ITS) LTD (GB) 2012-07-05 — — WO disclosed
US-6013773-A STABLE SOLUTION CONTAINING SOMATOTROPIN, NICOTINAMIDE AND SODIUM ACETYLTRYPTOPHANE ; FOR INCREASED SOLUBILITY OF SOMATOTROPIN MITSUI CHEMICALS, INC. (JP) 2000-01-11 — — US disclosed
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