SCHEMBL22404095

SCHEMBL22404095

C/C=C\C(=N)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
HTT P42858 2/20 0.42
KMT2A Q03164 2/20 0.42
HIF1A Q16665 1/20 0.42
LMNA P02545 2/20 0.41
TYR P14679 1/20 0.41
SRD5A2 P31213 1/20 0.41
CYP1A2 P05177 1/20 0.40
TSHR P16473 1/20 0.38
MAPT P10636 2/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
RARB P10826 1/20 0.38
RARG P13631 1/20 0.38
SIRT1 Q96EB6 1/20 0.37
NQO2 P16083 1/20 0.36
HDAC3 O15379 1/20 0.36

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
SCHEMBL21094943 0.78 HDAC1 (0.44) HDAC1ALDH1A1MEN1HTTKMT2A
SCHEMBL17273799 0.74 F2 (0.42) ALDH1A1MEN1KMT2ALMNATSHR
SCHEMBL23709159 0.73 LMNA (0.52) HDAC1ALDH1A1MEN1HTTKMT2A
SCHEMBL9889072 0.72 HDAC1 (0.50) HDAC1ALDH1A1MEN1HTTKMT2A
SCHEMBL19300410 0.71 HDAC1 (0.42) HDAC1ALDH1A1MEN1HTTKMT2A
SCHEMBL21185486 0.71 HDAC1 (0.38) HDAC1ALDH1A1MEN1HTTKMT2A
SCHEMBL22363237 0.70 HDAC1 (0.48) HDAC1ALDH1A1MEN1HTTKMT2A
SCHEMBL421322 0.70 NQO2 (0.60) HDAC1ALDH1A1LMNATYRSRD5A2
SCHEMBL22363236 0.70 HDAC1 (0.48) HDAC1ALDH1A1MEN1HTTKMT2A
SCHEMBL18537001 0.70 HDAC1 (0.48) HDAC1ALDH1A1MEN1HTTKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11758803-B2 Organometallic compound, organic light-emitting device including the same, and electronic apparatus including the organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-12 US disclosed
US-20230165095-A1 LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-25 US disclosed
US-20200287144-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-09-10 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-20200287144-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME, AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE L1CAM, MSL1, EML4 HDAC1 1374/4885ALDH1A1 61/4885MEN1 10/4885
US-11758803-B2 Organometallic compound, organic light-emitting device including the same, and electronic apparatus including the organic light-emitting device L1CAM, MSL1, EML4 HDAC1 1374/4885ALDH1A1 61/4885MEN1 10/4885

“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.