SCHEMBL9906079

SCHEMBL9906079

CC(=O)NC1C(O)O[C@@H](COS(=O)(=O)O)[C@@H](O[C@@H]2OC(CO)[C@@H](O[C@@H]3O[C@@H](CO)[C@@H](O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4N)C(O)C3NC(C)=O)[C@H](O)C2NC(C)=O)C1O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 6/20 0.47
▸ LGALS8 O00214 1/20 0.47
▸ LGALS4 P56470 1/20 0.47
▸ CD69 Q07108 1/20 0.47
▸ CHIA Q9BZP6 1/20 0.45
▸ BLM P54132 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ MAPK1 P28482 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ HPSE Q9Y251 2/20 0.41
▸ LGALS1 P09382 1/20 0.41
▸ LGALS7; LGALS7B P47929 1/20 0.41
▸ BMP2 P12643 1/20 0.40
▸ VEGFA P15692 1/20 0.40
▸ CXCL12 P48061 1/20 0.40
▸ SHH Q15465 1/20 0.40
▸ LGALS9 O00182 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
SCHEMBL20390690 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL14597949 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL25924399 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL16433860 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL18024607 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL18202527 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL16802126 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL16623683 1.00 LGALS3 (0.47) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL20390684 0.93 CD69 (0.53) LGALS3LGALS8LGALS4CD69CHIA
SCHEMBL20390670 0.93 CD69 (0.53) LGALS3LGALS8LGALS4CD69CHIA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8877684-B2 Pesticidal composition comprising a synthetic compound useful as nodulation agent of leguminous plants and an insecticide compound BAYER CROPSCIENCE AG (DE) 2014-11-04 — — US disclosed
US-8440591-B2 Pesticidal composition comprising synthetic compound useful as nodulation agent of leguminous plants and a fungicide compound BAYER CROPSCIENCE AG (DE) 2013-05-14 — — US disclosed
US-8198420-B2 Synthetic compounds useful as nodulation agents of leguminous plants and preparation processes thereof BAYER SAS (FR) 2012-06-12 — — US disclosed
US-20110281729-A1 SYNTHETIC COMPOUNDS USEFUL AS NODULATION AGENTS OF LEGUMINOUS PLANTS AND PREPARATION PROCESSES THEREOF BAYER SAS (FR) 2011-11-17 — — US disclosed
US-8013132-B2 Synthetic compounds useful as nodulation agents of leguminous plants and preparation processes thereof BAYER SAS (FR) 2011-09-06 — — US disclosed
US-20100160167-A1 Synthetic compounds useful as nodulation agents of leguminous plants and preparation processes thereof BAYER CROPSCIENCE S.A. (FR) 2010-06-24 — — US disclosed
US-20100113278-A1 PESTICIDAL COMPOSITION COMPRISING SYNTHETIC COMPOUND USEFUL AS NODULATION AGENT OF LEGUMINOUS PLANTS AND A FUNGICIDE COMPOUND BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-05-06 — — US disclosed
US-20100048404-A1 PESTICIDAL COMPOSITION COMPRISING A SYNTHETIC COMPOUND USEFUL AS NODULATION AGENT OF LEGUMINOUS PLANTS AND AN INSECTICIDE COMPOUND BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-02-25 — — US disclosed
US-7619076-B2 Nod factor type compounds; result in a large increase in the number of nitrogen-fixing root nodules; 2-acetamido-4-O-{2-acetamido-4-O-[2-acetamido-2-deoxy-4-O-(2-deoxy-2-(N-3-(undec-4Z-enyloxy)benzoyl)amino- beta -D-glucopyranosyl)- beta -D-glucopyranosyl]-2-deoxy- beta -D-glucopyranosyl}-2-deoxy-D-gluco BAYER CROPSCIENCE S.A. (FR) 2009-11-17 — — US disclosed
US-20070067921-A1 Synthetic compounds useful as nodulation agents of leguminous plants and preparation processes thereof INSTITUT NATIONAL DE RECHERCHE POUR L'AGRICULTURE, L'ALIMENTATION ET L'ENVIRONNEMENT (FR) 2007-03-29 — — 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 (5 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-20100048404-A1 PESTICIDAL COMPOSITION COMPRISING A SYNTHETIC COMPOUND USEFUL AS NODULATION AGENT OF LEGUMINOUS PLANTS AND AN INSECTICIDE COMPOUND CYP51A1, DDT, ACHE LGALS3 2407/4885LGALS8 2628/4885LGALS4 2059/4885
US-20070067921-A1 Synthetic compounds useful as nodulation agents of leguminous plants and preparation processes thereof LSS, BMP1, BMP4 LGALS3 3479/4885LGALS8 2437/4885LGALS4 2430/4885
US-20100113278-A1 PESTICIDAL COMPOSITION COMPRISING SYNTHETIC COMPOUND USEFUL AS NODULATION AGENT OF LEGUMINOUS PLANTS AND A FUNGICIDE COMPOUND CYP51A1, LSS, DDT LGALS3 2545/4885LGALS8 2193/4885LGALS4 1503/4885
US-20100160167-A1 Synthetic compounds useful as nodulation agents of leguminous plants and preparation processes thereof VEGFA, BMP1, VHL LGALS3 3242/4885LGALS8 1203/4885LGALS4 3379/4885
US-20110281729-A1 SYNTHETIC COMPOUNDS USEFUL AS NODULATION AGENTS OF LEGUMINOUS PLANTS AND PREPARATION PROCESSES THEREOF LSS, BMP1, BMP4 LGALS3 3513/4885LGALS8 2479/4885LGALS4 2432/4885

“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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