SCHEMBL27430951

SCHEMBL27430951

Cc1cc(C)cc(-c2ccc(-c3ccc(-c4cccnc4)cc3)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.60
CYP3A4 P08684 3/20 0.60
ALDH1A1 P00352 1/20 0.60
CYP1A2 P05177 1/20 0.60
KIF11 P52732 1/20 0.56
MKNK1 Q9BUB5 5/20 0.53
MKNK2 Q9HBH9 5/20 0.53
MEN1 O00255 1/20 0.53
PSIP1 O75475 1/20 0.53
AXL P30530 1/20 0.53
CYP19A1 P11511 3/20 0.52
CYP11B2 P19099 2/20 0.52
CYP17A1 P05093 1/20 0.52
CYP11B1 P15538 1/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
GRM5 P41594 1/20 0.49
APP P05067 1/20 0.49
CHEK1 O14757 1/20 0.49
AURKA O14965 1/20 0.49

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
SCHEMBL16547005 0.96 CYP2A6 (0.65) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL19309597 0.92 CYP2A6 (0.56) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL10262832 0.92 CYP2A6 (0.65) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL12070458 0.92 CYP2A6 (0.65) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL26550696 0.91 CYP11B2 (0.67) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL10263457 0.90 CYP19A1 (0.59) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL11996125 0.89 CYP2A6 (0.56) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL25623534 0.88 CYP2A6 (0.66) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11
SCHEMBL22693745 0.88 CYP2A6 (0.60) CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1
SCHEMBL12131368 0.88 CYP2A6 (0.60) CYP2A6CYP3A4ALDH1A1CYP1A2KIF11

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-20240217902-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2024-07-04 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-20240217902-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF EMC1, EMC2, AOC1 CYP2A6 2151/4885CYP3A4 1758/4885ALDH1A1 816/4885

“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.