SCHEMBL2977413

SCHEMBL2977413

COC1Oc2ccccc2CC1c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
HSD17B10 Q99714 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
CHRM2 P08172 2/20 0.38
CHRM4 P08173 2/20 0.38
CHRM5 P08912 2/20 0.38
CHRM1 P11229 2/20 0.38
CHRM3 P20309 2/20 0.38
MAOB P27338 5/20 0.38
AR P10275 2/20 0.38
CYP19A1 P11511 2/20 0.38
ADORA3 P0DMS8 1/20 0.38
HSP90AB1 P08238 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
ABCG2 Q9UNQ0 3/20 0.37

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
SCHEMBL16376659 0.78 CYP2C19 (0.47) KDM4EHSD17B10HPGDGABRA1GABRB2
SCHEMBL9390060 0.77 CHRM2 (0.40) KDM4EHSD17B10ALDH1A1HPGDGABRA1
SCHEMBL9374719 0.72 SIGMAR1 (0.44) KDM4EHSD17B10ALDH1A1HPGDGABRA1
SCHEMBL3356438 0.71 HPGD (0.43) HPGDGABRA1GABRB2CHRM2CHRM4
SCHEMBL27532834 0.70 CYP3A4 (0.49) GABRA1GABRB2MAOBARCYP19A1
SCHEMBL30633819 0.70 GABRA1 (0.53) GABRA1GABRB2MAOBARCYP19A1
SCHEMBL403523 0.70 MAOB (0.65) KDM4EHSD17B10ALDH1A1HPGDMAOB
SCHEMBL32498549 0.70 MAOB (0.65) KDM4EHSD17B10ALDH1A1HPGDMAOB
SCHEMBL23867147 0.69 HSP90AB1 (0.44) KDM4EHSD17B10ALDH1A1HPGDGABRA1
SCHEMBL11044983 0.69 HSP90AB1 (0.44) KDM4EHSD17B10ALDH1A1HPGDGABRA1

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230255989-A1 GLYCAN COMPOSITIONS AND USES THEREOF DSM NUTRITIONAL PRODUCTS LLC (US) 2023-08-17 US disclosed
US-11229660-B2 Glycan therapeutics and method of treating conditions associated with TMAO KALEIDO BIOSCIENCES, INC. (US) 2022-01-25 US disclosed
WO-2021117016-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF INFLAMMATION WITH STEROIDS AND A MODULATOR BUZZELET DEVELOPMENT AND TECHNOLOGIES LTD. (IL) 2021-06-17 WO disclosed
US-20210137956-A1 GLYCAN COMPOSITIONS AND USES THEREOF HERCULES CAPITAL, INC. 2021-05-13 US disclosed
US-20210113596-A1 GLYCAN THERAPEUTICS AND RELATED METHODS THEREOF KALEIDO BIOSCIENCES, INC. (US) 2021-04-22 US disclosed
US-10881676-B2 Glycan therapeutics and related methods thereof KALEIDO BIOSCIENCES, INC. (US) 2021-01-05 US disclosed
US-10702542-B2 Glycan therapeutics and related methods thereof KALEIDO BIOSCIENCES, INC. (US) 2020-07-07 US disclosed
US-20200093845-A1 GLYCAN THERAPEUTICS AND RELATED METHODS THEREOF HERCULES CAPITAL, INC. 2020-03-26 US disclosed
US-20200093851-A1 GLYCAN THERAPEUTICS AND RELATED METHODS THEREOF HERCULES CAPITAL, INC. 2020-03-26 US disclosed
US-20190391092-A1 METABOLIC PROFILING WITH MAGNETIC RESONANCE MASS SPECTROMETRY (MRMS) Oregon Institute of Science and Medicine 2019-12-26 US disclosed
US-20170246201-A1 GLYCAN THERAPEUTICS AND RELATED METHODS THEREOF HERCULES CAPITAL, INC. 2017-08-31 US disclosed
US-20170151269-A1 GLYCAN THERAPEUTICS AND RELATED METHODS THEREOF HERCULES CAPITAL, INC. 2017-06-01 US disclosed
US-20170151268-A1 GLYCAN THERAPEUTICS AND RELATED METHODS THEREOF HERCULES CAPITAL, INC. 2017-06-01 US disclosed
US-9492473-B2 Glycan therapeutics and related methods thereof KALEIDO BIOSCIENCES, INC. (US) 2016-11-15 US disclosed
US-20160213702-A1 GLYCAN THERAPEUTICS AND RELATED METHODS THEREOF KALEIDO BIOSCIENCES, INC. (US) 2016-07-28 US disclosed
US-20150150770-A1 METHODS OF TREATING SKIN TRACIE MARTYN INTERNATIONAL INC (US) 2015-06-04 US disclosed
US-20140155961-A1 METHODS OF TREATING SKIN Tracie Martyn International, Inc. (US) 2014-06-05 US disclosed
US-20100272790-A1 Methods of Treating Skin TRACIE MARTYN INTERNATIONAL, LLC (US) 2010-10-28 US disclosed
US-7776915-B2 Topical formulations and methods of use TRACIE MARTYN INTERNATIONAL, LLC (US) 2010-08-17 US disclosed
US-20060216251-A1 Topical formulations and methods of use TRACIE MARTYN INTERNATIONAL, LLC (US) 2006-09-28 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 (4 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-20140155961-A1 METHODS OF TREATING SKIN CUTA, LIPA, DLAT KDM4E 1602/4885HSD17B10 583/4885ALDH1A1 920/4885
US-20100272790-A1 Methods of Treating Skin CUTA, LIPA, DLAT KDM4E 1602/4885HSD17B10 583/4885ALDH1A1 920/4885
US-20150150770-A1 METHODS OF TREATING SKIN CUTA, LIPA, DLAT KDM4E 1602/4885HSD17B10 583/4885ALDH1A1 920/4885
US-20060216251-A1 Topical formulations and methods of use CPT1B, SLC25A20, CPT1A KDM4E 2265/4885HSD17B10 512/4885ALDH1A1 313/4885

“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.