SCHEMBL14435009

SCHEMBL14435009

Cc1ccc(C2Nc3ccc(SOON)cc3C3OCCC23)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.58
KIF11 P52732 14/20 0.53
HNF4A P41235 1/20 0.42
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NLRP3 Q96P20 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL5533184 0.82 GAA (0.81) GAAKIF11HNF4AHPGDSMN1; SMN2
SCHEMBL14435023 0.81 KIF11 (0.40) GAAKIF11HNF4ANLRP3MAPT
SCHEMBL14435020 0.81 KIF11 (0.40) GAAKIF11HNF4ANLRP3MAPT
SCHEMBL14435016 0.78 MAPT (0.49) GAAHPGDKDM4EALDH1A1TP53
SCHEMBL14435015 0.78 MAPT (0.49) GAAHPGDKDM4EALDH1A1TP53
SCHEMBL14435013 0.78 MAPT (0.49) GAAHPGDKDM4EALDH1A1TP53
SCHEMBL14435014 0.78 MAPT (0.49) GAAHPGDKDM4EALDH1A1TP53
SCHEMBL28162395 0.77 KIF11 (0.86) GAAKIF11HNF4ANLRP3
SCHEMBL5514635 0.76 GAA (0.64) GAAKIF11HNF4ANLRP3
SCHEMBL15321012 0.72 GAA (0.69) GAAKIF11HNF4A

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-20070179172-A1 Positive modulators of nicotinic acetylcholine receptors ASTRAZENECA AB (SE) 2007-08-02 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-20070179172-A1 Positive modulators of nicotinic acetylcholine receptors CHRNA1, CHRNA2, CHRM1 GAA 2936/4885KIF11 3859/4885HNF4A 3088/4885

“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.