Morpholine

Morpholine

SCHEMBL3316539

C1COCCN1.CC(=O)OC(C)C

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
CYP2C9 P11712 1/20 0.42
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 1/20 0.31
GALR3 O60755 1/20 0.31
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
Dioxane SCHEMBL1741544 0.85 TSHR (0.70) TSHRMEN1KMT2AKDM4EGAA
Tetrahydrofuran SCHEMBL2502942 0.81 TSHR (0.64) TSHRMEN1KMT2ACHRM2CHRM4
Morpholine SCHEMBL28126679 0.79 MEN1 (0.50) TSHRMEN1KMT2AKDM4EGAA
Morpholine SCHEMBL27737341 0.78 GAA (0.61) TSHRMEN1KMT2AKDM4EGAA
Dioxane SCHEMBL4036904 0.78 TSHR (0.58) TSHRMEN1KMT2AGAACHRM2
SCHEMBL4977794 0.76 TSHR (0.56) TSHRMEN1KMT2AGAAMAPT
Morpholine SCHEMBL23929419 0.75 MEN1 (0.58) TSHRMEN1KMT2AKDM4EGAA
Morpholine SCHEMBL29207396 0.75 KMT2A (0.58) TSHRMEN1KMT2AKDM4EGAA
Morpholine SCHEMBL219044 0.75 KMT2A (0.58) TSHRMEN1KMT2AKDM4EGAA
SCHEMBL21064874 0.75 TSHR (1.00) TSHRCHRM2CHRM4CHRM1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7838550-B2 Selective N-sulfonylation of 2-amino fluoro- and trifluoroalkyl substituted alcohols WYETH LLC (US) 2010-11-23 US claimed
US-7687666-B2 Methods for preparing sulfonamide substituted alcohols and intermediates thereof WYETH (US) 2010-03-30 US claimed
EP-1984321-A1 METHODS FOR PREPARING SULFONAMIDE SUBSTITUTED ALCOHOLS AND INTERMEDIATES THEREOF Wyeth (US) 2008-10-29 EP claimed
WO-2007098029-A1 METHODS FOR PREPARING SULFONAMIDE SUBSTITUTED ALCOHOLS AND INTERMEDIATES THEREOF WYETH (US) 2007-08-30 WO claimed
US-20070197800-A1 Selective n-sulfonylation of 2-amino flouro-and trifluoroalkyl substituted alcohols WYETH (US) 2007-08-23 US claimed
US-20070197830-A1 Methods for preparing sulfonamide substituted alcohols and intermediates thereof WYETH (US) 2007-08-23 US claimed
US-7838550-B2 Selective N-sulfonylation of 2-amino fluoro- and trifluoroalkyl substituted alcohols WYETH LLC (US) 2010-11-23 US disclosed
US-7687666-B2 Methods for preparing sulfonamide substituted alcohols and intermediates thereof WYETH (US) 2010-03-30 US disclosed
EP-1984347-A1 SELECTIVE N-SULFONYLATION OF 2-AMINO TRIFLUOROALKYL SUBSTITUTED ALCOHOLS Wyeth a Corporation of the State of Delaware (US) 2008-10-29 EP disclosed
EP-1984321-A1 METHODS FOR PREPARING SULFONAMIDE SUBSTITUTED ALCOHOLS AND INTERMEDIATES THEREOF Wyeth (US) 2008-10-29 EP disclosed
WO-2007098029-A1 METHODS FOR PREPARING SULFONAMIDE SUBSTITUTED ALCOHOLS AND INTERMEDIATES THEREOF WYETH (US) 2007-08-30 WO disclosed
WO-2007098030-A1 SELECTIVE N-SULFONYLATION OF 2-AMINO TRIFLUOROALKYL SUBSTITUTED ALCOHOLS WYETH (US) 2007-08-30 WO disclosed
US-20070197800-A1 Selective n-sulfonylation of 2-amino flouro-and trifluoroalkyl substituted alcohols WYETH (US) 2007-08-23 US disclosed
US-20070197830-A1 Methods for preparing sulfonamide substituted alcohols and intermediates thereof WYETH (US) 2007-08-23 US 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-20070197800-A1 Selective n-sulfonylation of 2-amino flouro-and trifluoroalkyl substituted alcohols BRAF, AFF2, SELENOI TSHR 737/4885MEN1 1984/4885KMT2A 262/4885
US-20070197830-A1 Methods for preparing sulfonamide substituted alcohols and intermediates thereof ADH1A, STS, ADH1C TSHR 1736/4885MEN1 2965/4885KMT2A 625/4885

“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.