SCHEMBL11413705

SCHEMBL11413705

CCc1cccc(O)c1NC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.52
GABRB2 P47870 2/20 0.52
SCN5A Q14524 4/20 0.49
KCNH2 Q12809 2/20 0.49
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
HIF1A Q16665 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HSPA5 P11021 1/20 0.43
CLCN2 P51788 1/20 0.42
IAPP P10997 2/20 0.41
CACNA1C Q13936 3/20 0.40
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
NLRP3 Q96P20 1/20 0.40
ANPEP P15144 1/20 0.40
DPP4 P27487 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
SCHEMBL7196230 0.84 SCN5A (0.57) GABRA1GABRB2SCN5AKCNH2ALOX15
Hydrochloric Acid SCHEMBL2864438 0.82 SCN5A (0.55) GABRA1GABRB2SCN5AKCNH2ALOX15
SCHEMBL27839986 0.82 SCN5A (0.55) GABRA1GABRB2SCN5AKCNH2ALOX15
SCHEMBL13887328 0.82 HSPA5 (0.41) GABRA1GABRB2TSHRHIF1AHSPA5
SCHEMBL11439324 0.79 CA2 (0.45) ALOX15TSHRHIF1ATDP1HSPA5
SCHEMBL6885169 0.79 GABRA1 (0.47) GABRA1GABRB2SCN5AKCNH2ALOX15
SCHEMBL7773986 0.77 CXCR2 (0.55) GABRA1GABRB2TSHRCLCN2GAA
SCHEMBL2868352 0.77 SCN5A (0.50) GABRA1GABRB2SCN5AKCNH2ALOX15
Dimethylamine SCHEMBL17027568 0.76 HSPA5 (0.61) GABRA1GABRB2TSHRHIF1AHSPA5
SCHEMBL11660113 0.75 KCNH2 (0.49) GABRA1GABRB2SCN5AKCNH2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11168249-B1 Luminescent polydentate polycyclic compounds for metal ions ZAVALETA FERNANDEZ DE CORDOVA ANDRES (US) 2021-11-09 US disclosed
US-4196286-A Process for the manufacture of basic oxazine dyestuffs CIBA-GEIGY CORPORATION (US) 1980-04-01 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-11168249-B1 Luminescent polydentate polycyclic compounds for metal ions PCBP1, CACYBP, CA9 GABRA1 2722/4885GABRB2 3848/4885SCN5A 4050/4885

“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.