SCHEMBL24327301

SCHEMBL24327301

C=C(/C=C(/C)CC)c1ccccn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 7/20 0.43
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
LMNA P02545 5/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NAPRT Q6XQN6 1/20 0.39
P4HTM Q9NXG6 1/20 0.39
MAPK1 P28482 2/20 0.39
TOP2A P11388 1/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
HTT P42858 4/20 0.38
RAB9A P51151 4/20 0.38
PTBP1 P26599 1/20 0.38
OPRK1 P41145 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 3/20 0.38
USP2 O75604 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38

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
SCHEMBL20903545 0.87 ALDH1A1 (0.43) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL25129177 0.83 ALDH1A1 (0.42) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL22947616 0.82 ALDH1A1 (0.52) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL22258120 0.77 ALDH1A1 (0.46) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL19322284 0.77 MAPK1 (0.49) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL455188 0.76 CES2 (0.50) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL22754517 0.75 ALDH1A1 (0.44) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL15468532 0.75 ALDH1A1 (0.43) ALDH1A1KDM4ECES2CES1LMNA
SCHEMBL472967 0.74 ALDH1A1 (0.50) ALDH1A1KDM4ECES2CES1LMNA
Bromide SCHEMBL27970014 0.73 ALDH1A1 (0.48) ALDH1A1KDM4ECES2CES1LMNA

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-20230403934-A1 LIGHT EMITTING ELEMENT AND POLYCYCLIC COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-12-14 US disclosed
US-20220077396-A1 LIGHT EMITTING ELEMENT AND MONOAMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2022-03-10 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 (2 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-20230403934-A1 LIGHT EMITTING ELEMENT AND POLYCYCLIC COMPOUND FOR THE SAME NFE2L2, ESR1, ELP1 ALDH1A1 147/4885KDM4E 787/4885CES2 814/4885
US-20220077396-A1 LIGHT EMITTING ELEMENT AND MONOAMINE COMPOUND FOR THE SAME MAOA, TPH2, TPH1 ALDH1A1 117/4885KDM4E 163/4885CES2 326/4885

“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.