SCHEMBL24434864

SCHEMBL24434864

CC(C)/C=C\c1ccc(CC(C)/C=C\c2ccncc2)nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
HPGD P15428 2/20 0.38
CYP1A2 P05177 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
AKT1 P31749 8/20 0.36
MAPT P10636 2/20 0.35
MEN1 O00255 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
HBB P68871 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ROCK2 O75116 4/20 0.34
PRKACA P17612 4/20 0.34

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
SCHEMBL24434469 0.79 ROCK2 (0.46) CYP1A2AKT1ROCK2PRKACAROCK1
SCHEMBL24434618 0.78 NPC1 (0.52) SMN1; SMN2NPC1RAB9AHPGDCYP1A2
SCHEMBL9967777 0.78 NPC1 (0.52) SMN1; SMN2NPC1RAB9AHPGDCYP1A2
SCHEMBL12437348 0.75 TUBB4A (0.32) MAPTESR1ESR2
SCHEMBL24225566 0.75 KDM4E (0.47) SMN1; SMN2CYP1A2KDM4ECYP3A4CYP2D6
SCHEMBL23639908 0.71 NPC1 (0.41) SMN1; SMN2NPC1RAB9AHPGDCYP1A2
SCHEMBL10141722 0.68 MEN1 (0.34) CYP1A2CYP2C19MAPTMEN1KMT2A
SCHEMBL20361755 0.66 NFE2L2 (0.44) SMN1; SMN2NPC1RAB9AMAPTMEN1
SCHEMBL21714772 0.66 NFE2L2 (0.44) SMN1; SMN2NPC1RAB9AMAPTMEN1
SCHEMBL18714919 0.66 NFE2L2 (0.44) SMN1; SMN2NPC1RAB9AMAPTMEN1

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-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 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-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G SMN1; SMN2 4057/4885NPC1 407/4885RAB9A 222/4885

“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.