SCHEMBL7248349

SCHEMBL7248349

CCCNc1cc2cocc2cc1OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 3/20 0.36
CASP3 P42574 2/20 0.36
SENP8 Q96LD8 2/20 0.36
SENP7 Q9BQF6 2/20 0.36
SENP6 Q9GZR1 2/20 0.36
APAF1 O14727 1/20 0.36
TDP2 O95551 1/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.36
PGK1 P00558 2/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
BRD4 O60885 1/20 0.32
CRHR1 P34998 1/20 0.32
APP P05067 2/20 0.32
BCHE P06276 2/20 0.32
ACHE P22303 2/20 0.32
PTGS2 P35354 1/20 0.32

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
SCHEMBL28203968 0.73 ALDH1A1 (0.50) ALDH1A1PGK1SMN1; SMN2ACHEKDM4E
SCHEMBL7530707 0.72 ALDH1A1 (0.51) ALDH1A1HSD17B10GAAMAPK1PGK1
SCHEMBL8335123 0.72 HTR2A (0.51) SMN1; SMN2
SCHEMBL7059303 0.72 HTR2A (0.40) ALDH1A1MAPK1CYP1A2SMN1; SMN2LMNA
SCHEMBL7525330 0.72 ALDH1A1 (0.50) ALDH1A1CASP3SENP8SENP7SENP6
SCHEMBL30018702 0.69 PDE4A (0.46) ALDH1A1HSD17B10PGK1SMN1; SMN2ACHE
SCHEMBL5663443 0.69 KMT2A (0.51) ALDH1A1HSD17B10GAAMAPK1CYP1A2
SCHEMBL7531918 0.69 MAPT (0.59) ALDH1A1GAAMAPK1SMN1; SMN2ACHE
SCHEMBL13159618 0.69 ACHE (0.48) ALDH1A1GAAMAPK1CRHR1ACHE
SCHEMBL12963035 0.68 ALDH1A1 (0.42) ALDH1A1GAAMAPK1CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030032667-A1 PROCESS FOR PREPARING AMIC ACID ESTERS IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2003-02-13 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 (1 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-20030032667-A1 PROCESS FOR PREPARING AMIC ACID ESTERS MCCC2, EMC1, GANC ALDH1A1 651/4885HSD17B10 214/4885CASP3 3428/4885

“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.