SCHEMBL18359692

SCHEMBL18359692

Cc1cc(C)c(O)c(CN(C)CC(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
HPGD P15428 2/20 0.48
CYP1A2 P05177 1/20 0.48
CASP1 P29466 1/20 0.48
CYP2C19 P33261 1/20 0.48
CASP7 P55210 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HIF1A Q16665 1/20 0.47
EGFR P00533 4/20 0.44
ERBB2 P04626 3/20 0.44
VEGFA P15692 1/20 0.44
EGLN1 Q9GZT9 1/20 0.44
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
KDM4E B2RXH2 2/20 0.36
CD274 Q9NZQ7 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 2/20 0.35
GLA P06280 1/20 0.35
ALOX12 P18054 1/20 0.35

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
SCHEMBL19165160 0.92 HIF1A (0.50) ALDH1A1HPGDCYP1A2CASP1CYP2C19
SCHEMBL19485050 0.84 HIF1A (0.44) ALDH1A1HPGDCYP1A2CASP1CYP2C19
SCHEMBL5265431 0.83 EGFR (0.43) ALDH1A1HPGDCYP1A2CASP1CYP2C19
SCHEMBL18359717 0.82 HIF1A (0.43) ALDH1A1HPGDCYP1A2CASP1CYP2C19
SCHEMBL10360605 0.81 EGFR (0.44) ALDH1A1HPGDCYP1A2CASP1CYP2C19
SCHEMBL6053403 0.81 EGFR (0.41) ALDH1A1CYP1A2CYP2C19HSD17B10HIF1A
SCHEMBL13318451 0.80 EGFR (0.40) ALDH1A1CYP1A2CYP2C19HSD17B10HIF1A
SCHEMBL19165801 0.79 HPGD (0.52) ALDH1A1HPGDCYP1A2CASP1CYP2C19
SCHEMBL10809043 0.78 ALDH1A1 (0.46) ALDH1A1HPGDCYP1A2CASP1CYP2C19
SCHEMBL10936707 0.77 GLA (0.53) ALDH1A1HPGDCYP1A2CASP1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10793482-B2 Compounds and compositions for delivery of nutrients and micronutrients to plants SPERO ENERGY, INC. (US) 2020-10-06 US disclosed
US-20180208514-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERY OF NUTRIENTS AND MICRONUTRIENTS TO PLANTS SPERO ENERGY, INC. 2018-07-26 US disclosed
US-20180208514-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERY OF NUTRIENTS AND MICRONUTRIENTS TO PLANTS SPERO ENERGY, INC. 2018-07-26 US disclosed
WO-2017004052-A2 COMPOUNDS AND COMPOSITIONS FOR DELIVERY OF NUTRIENTS AND MICRONUTRIENTS TO PLANTS SPERO ENERGY, INC. (US) 2017-01-05 WO 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-10793482-B2 Compounds and compositions for delivery of nutrients and micronutrients to plants SLC19A1, SLC19A2, SLC39A3 ALDH1A1 2893/4885HPGD 714/4885CYP1A2 1533/4885
US-20180208514-A1 COMPOUNDS AND COMPOSITIONS FOR DELIVERY OF NUTRIENTS AND MICRONUTRIENTS TO PLANTS SLC19A1, SLC19A2, SLC39A3 ALDH1A1 2893/4885HPGD 714/4885CYP1A2 1533/4885

“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.