SCHEMBL23618281

SCHEMBL23618281

C=C(NC)NC1CCCCCCC1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.46
EPHX1 P07099 7/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
NPC1 O15118 3/20 0.46
ALDH1A1 P00352 2/20 0.46
CYP3A4 P08684 2/20 0.46
RAB9A P51151 2/20 0.46
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
KDM4E B2RXH2 1/20 0.46
EPHX2 P34913 1/20 0.46
GAA P10253 2/20 0.41
HTT P42858 1/20 0.41
LMNA P02545 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
SCHEMBL25484597 1.00 SIGMAR1 (0.46) SIGMAR1EPHX1SMN1; SMN2NPC1ALDH1A1
SCHEMBL19142695 0.98 SIGMAR1 (0.43) SIGMAR1EPHX1SMN1; SMN2NPC1ALDH1A1
SCHEMBL19346264 0.93
SCHEMBL14378653 0.87
SCHEMBL18823623 0.85 EPHX1 (0.55) SIGMAR1EPHX1SMN1; SMN2NPC1ALDH1A1
SCHEMBL24022707 0.85 EPHX1 (0.55) SIGMAR1EPHX1SMN1; SMN2NPC1ALDH1A1
SCHEMBL25597375 0.76 P2RX4 (0.36) SIGMAR1ALDH1A1KDM4E
SCHEMBL18807454 0.75 EPHX1 (0.50) SIGMAR1EPHX1SMN1; SMN2NPC1ALDH1A1
SCHEMBL8336708 0.75 EPHX1 (0.50) SIGMAR1EPHX1SMN1; SMN2NPC1ALDH1A1
SCHEMBL16076630 0.74 EPHX1 (0.43) SIGMAR1EPHX1SMN1; SMN2NPC1ALDH1A1

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-20210205467-A1 RAAV WITH CHEMICALLY MODIFIED CAPSID CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2021-07-08 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-20210205467-A1 RAAV WITH CHEMICALLY MODIFIED CAPSID IGF2R, CFH, M6PR SIGMAR1 2082/4885EPHX1 3370/4885SMN1; SMN2 746/4885

“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.