SCHEMBL12330736

SCHEMBL12330736

CCCCCCCCCCCCCCC/C=C/[C@H](O)[C@H](N)CO

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SPHK2 Q9NRA0 12/20 1.00
▸ SPHK1 Q9NYA1 12/20 1.00
▸ MAPT P10636 4/20 1.00
▸ MEN1 O00255 3/20 1.00
▸ KMT2A Q03164 3/20 1.00
▸ CETP P11597 3/20 1.00
▸ MAPK1 P28482 3/20 1.00
▸ CYP2D6 P10635 3/20 1.00
▸ ALDH1A1 P00352 3/20 1.00
▸ GMNN O75496 2/20 1.00
▸ LMNA P02545 2/20 1.00
▸ GLA P06280 2/20 1.00
▸ POLB P06746 2/20 1.00
▸ THRB P10828 2/20 1.00
▸ CXCR5 P32302 2/20 1.00
▸ CCR6 P51684 2/20 1.00
▸ BLM P54132 2/20 1.00
▸ UBE2N P61088 2/20 1.00
▸ TP53 P04637 2/20 1.00
▸ CYP1A2 P05177 2/20 1.00

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
Sphingosine SCHEMBL1471985 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
Sphingosine SCHEMBL15650079 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
Sphingosine SCHEMBL22911044 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
SCHEMBL22986843 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
SCHEMBL21428474 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
SCHEMBL22986939 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
SCHEMBL20819097 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
Sphingosine SCHEMBL21114357 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
SCHEMBL21428477 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A
Sphingosine SCHEMBL10056604 1.00 SPHK2 (1.00) SPHK2SPHK1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11298412-B2 Sphingoid compounds for prophylaxis and/or therapy of coronaviridae infection Harbins Ruhr Bioscience, Inc. (US) 2022-04-12 — — US disclosed
WO-2022015348-A1 SPHINGOID COMPOUNDS FOR USE IN PROPHYLAXIS AND/OR THERAPY OF CORONAVIRIDAE INFECTION Harbins Ruhr Bioscience, Inc. (US) 2022-01-20 — — WO disclosed
US-20220016222-A1 SPHINGOID COMPOUNDS FOR PROPHYLAXIS AND/OR THERAPY OF CORONAVIRIDAE INFECTION Harbins Ruhr Bioscience, Inc. 2022-01-20 — — US disclosed
US-20200268686-A1 SPHINGOID COMPOUNDS FOR PROPHYLAXIS AND/OR THERAPY OF A VIRAL INFECTION Harbins Ruhr Bioscience, Inc. 2020-08-27 — — US disclosed
US-10688065-B2 Sphingoid compounds for prophylaxis and/or therapy of a viral infection Harbins Ruhr Bioscience, Inc. (US) 2020-06-23 — — US disclosed
US-20200113850-A1 SPHINGOID COMPOUNDS FOR PROPHYLAXIS AND/OR THERAPY OF A VIRAL INFECTION Harbins Ruhr Bioscience, Inc. 2020-04-16 — — US disclosed
US-10294504-B2 Mutant endoglycoceramidases with enhanced synthetic activity LA JOLLA PHARMACEUTICAL COMPANY (US) 2019-05-21 — — US disclosed
US-20160032342-A1 Mutant Endoglycoceramidases with Enhanced Synthetic Activity SENEB BIOSCIENCES, INC. (US) 2016-02-04 — — US disclosed
US-20150258043-A1 USE OF SPHINGOID LONG CHAIN BASES AND THEIR ANALOGS IN TREATING AND PREVENTING BACTERIAL INFECTIONS UNIVERSITY OF DUISBURG-ESSEN (DE) 2015-09-17 — — US disclosed
US-20150258043-A1 USE OF SPHINGOID LONG CHAIN BASES AND THEIR ANALOGS IN TREATING AND PREVENTING BACTERIAL INFECTIONS UNIVERSITY OF DUISBURG-ESSEN (DE) 2015-09-17 — — US disclosed
US-9068208-B2 Mutant endoglycoceramidases with enhanced synthetic activity SENEB BIOSCIENCES, INC. (US) 2015-06-30 — — US disclosed
US-20140147891-A1 MUTANT ENDOGLYCOCERAMIDASES WITH ENHANCED SYNTHETIC ACTIVITY The University of British Columbia University- Industry Liaison Office (CA) 2014-05-29 — — US disclosed
EP-1765998-B1 MUTANT ENDOGLYCOCERAMIDASES WITH ENHANCED SYNTHETIC ACTIVITY SENEB BIOSCIENCES INC (US) 2011-09-21 — — EP disclosed
US-20090176278-A1 SOLVENTS FOR MUTANT ENDOGLYCOCERAMIDASES WITH SYNTHETIC ACTIVITY NEOSE TECHNOLOGIES, INC. (US) 2009-07-09 — — US disclosed
US-20090170155-A1 Mutant Endoglycoceramidases With Enhanced Synthetic Activity THE UNIVERSITY OF BRITISH COLUMBIA UNIVERSITY-INDU (CA) 2009-07-02 — — US disclosed
US-20090170155-A1 Mutant Endoglycoceramidases With Enhanced Synthetic Activity THE UNIVERSITY OF BRITISH COLUMBIA UNIVERSITY-INDU (CA) 2009-07-02 — — 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 (7 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-20200268686-A1 SPHINGOID COMPOUNDS FOR PROPHYLAXIS AND/OR THERAPY OF A VIRAL INFECTION SPHK1, SPHK2, S1PR1 SPHK2 2/4885SPHK1 1/4885MAPT 3657/4885
US-20220016222-A1 SPHINGOID COMPOUNDS FOR PROPHYLAXIS AND/OR THERAPY OF CORONAVIRIDAE INFECTION SPHK1, SPHK2, S1PR2 SPHK2 2/4885SPHK1 1/4885MAPT 2784/4885
US-10688065-B2 Sphingoid compounds for prophylaxis and/or therapy of a viral infection SPHK1, SPHK2, S1PR1 SPHK2 2/4885SPHK1 1/4885MAPT 3657/4885
US-20200113850-A1 SPHINGOID COMPOUNDS FOR PROPHYLAXIS AND/OR THERAPY OF A VIRAL INFECTION SPHK1, SPHK2, S1PR1 SPHK2 2/4885SPHK1 1/4885MAPT 3657/4885
US-20150258043-A1 USE OF SPHINGOID LONG CHAIN BASES AND THEIR ANALOGS IN TREATING AND PREVENTING BACTERIAL INFECTIONS SPTSSB, CFTR, SGMS1 SPHK2 11/4885SPHK1 9/4885MAPT 4123/4885
US-20090170155-A1 Mutant Endoglycoceramidases With Enhanced Synthetic Activity ENGASE, UGCG, GBA1 SPHK2 292/4885SPHK1 226/4885MAPT 4584/4885
US-11298412-B2 Sphingoid compounds for prophylaxis and/or therapy of coronaviridae infection SPHK1, SPHK2, S1PR2 SPHK2 2/4885SPHK1 1/4885MAPT 2784/4885

“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.

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