SCHEMBL2183672

SCHEMBL2183672

O=C(O)CC(O)(C(=O)O)C(OC(=O)O)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.53
CPT2 P23786 1/20 0.53
HSPD1 P10809 1/20 0.41
BLM P54132 1/20 0.41
HSPE1 P61604 1/20 0.41
ALDH1A1 P00352 1/20 0.38
HMGCR P04035 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33
CYP2D6 P10635 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL8439897 0.81 ACLY (0.55) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL4657489 0.80 ACLY (0.53) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL8567208 0.77 CPT2 (0.50) ACLYCPT2HSPD1BLMHSPE1
SCHEMBL2870941 0.74 BLM (0.55) HSPD1BLMHSPE1ALDH1A1TSHR
SCHEMBL2870981 0.74 BLM (0.55) HSPD1BLMHSPE1ALDH1A1TSHR
SCHEMBL2863429 0.74 BLM (0.55) HSPD1BLMHSPE1ALDH1A1TSHR
SCHEMBL2872960 0.74 BLM (0.55) HSPD1BLMHSPE1ALDH1A1TSHR
SCHEMBL2869644 0.74 BLM (0.55) HSPD1BLMHSPE1ALDH1A1TSHR
SCHEMBL2865743 0.74 BLM (0.55) HSPD1BLMHSPE1ALDH1A1TSHR
SCHEMBL2864585 0.74 BLM (0.55) HSPD1BLMHSPE1ALDH1A1TSHR

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-11959065-B2 Bacillus megaterium bioactive compositions and metabolites PRO FARM GROUP, INC. (US) 2024-04-16 US disclosed
US-11384332-B2 Bacillus megaterium bioactive compositions and metabolites MARRONE BIO INNOVATIONS, INC. (US) 2022-07-12 US disclosed
US-20200267991-A1 BACILLUS MEGATERIUM BIOACTIVE COMPOSITIONS AND METABOLITES MARRONE BIO INNOVATIONS, INC. (US) 2020-08-27 US disclosed
US-10602743-B2 Method of inducing drought/salt tolerance using Bacillus megaterium MARRONE BIO INNOVATIONS, INC. (US) 2020-03-31 US disclosed
US-9801386-B2 Bacillus megaterium bioactive compositions and metabolites MARRONE BIO INNOVATIONS, INC. (US) 2017-10-31 US disclosed
US-20160113288-A1 Bacillus Megaterium as Drought/Salt Inducer PRO FARM GROUP, INC. 2016-04-28 US disclosed
US-20150305346-A1 BACILLUS MEGATERIUM BIOACTIVE COMPOSITIONS AND METABOLITES MARRONE BIO INNOVATIONS, INC. 2015-10-29 US disclosed
US-9084428-B2 Bacillus megaterium bioactive compositions and metabolites MARRONE BIO INNOVATIONS, INC. (US) 2015-07-21 US disclosed
US-20140051571-A1 BACILLUS MEGATERIUM BIOACTIVE COMPOSITIONS AND METABOLITES PRO FARM GROUP, INC. 2014-02-20 US disclosed
US-20110165294-A1 ABSORBENT PADS FOR FOOD PACKAGING NOVIPAX INC. 2011-07-07 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-20200267991-A1 BACILLUS MEGATERIUM BIOACTIVE COMPOSITIONS AND METABOLITES GZMB, VIP, BAX ACLY 2675/4885CPT2 1596/4885HSPD1 1366/4885
US-20140051571-A1 BACILLUS MEGATERIUM BIOACTIVE COMPOSITIONS AND METABOLITES GZMB, VIP, BAX ACLY 2675/4885CPT2 1596/4885HSPD1 1366/4885
US-11959065-B2 Bacillus megaterium bioactive compositions and metabolites GZMB, VIP, BAX ACLY 2675/4885CPT2 1596/4885HSPD1 1366/4885
US-20150305346-A1 BACILLUS MEGATERIUM BIOACTIVE COMPOSITIONS AND METABOLITES GZMB, VIP, BAX ACLY 2675/4885CPT2 1596/4885HSPD1 1366/4885
US-11384332-B2 Bacillus megaterium bioactive compositions and metabolites GZMB, VIP, BAX ACLY 2675/4885CPT2 1596/4885HSPD1 1366/4885

“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.