SCHEMBL25564477

SCHEMBL25564477

Cc1ccc(C(=O)OCc2ccccc2)c(-c2ccccc2I)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.48
ALDH1A1 P00352 5/20 0.48
TDP1 Q9NUW8 3/20 0.47
L3MBTL1 Q9Y468 3/20 0.45
TSHR P16473 2/20 0.45
CYP3A4 P08684 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 4/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
MAPT P10636 3/20 0.43
RAB9A P51151 3/20 0.43
LMNA P02545 2/20 0.43
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 2/20 0.43
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41

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
SCHEMBL25564476 0.90 DHODH (0.48) DHODHALDH1A1TDP1L3MBTL1TSHR
SCHEMBL25708252 0.87 ALDH1A1 (0.48) ALDH1A1TDP1L3MBTL1TSHRCYP3A4
SCHEMBL28216134 0.85 ALDH1A1 (0.54) DHODHALDH1A1TDP1L3MBTL1TSHR
SCHEMBL21726023 0.85 ALDH1A1 (0.61) ALDH1A1TDP1L3MBTL1TSHRCYP3A4
SCHEMBL4812204 0.82 ALDH1A1 (0.54) DHODHALDH1A1TDP1L3MBTL1TSHR
SCHEMBL29309832 0.81 ALDH1A1 (0.44) DHODHALDH1A1TDP1L3MBTL1TSHR
SCHEMBL28557117 0.79 KMT2A (0.59) DHODHALDH1A1TDP1L3MBTL1TSHR
SCHEMBL25910681 0.79 DHODH (0.54) DHODHALDH1A1TDP1L3MBTL1TSHR
Hydrochloric Acid SCHEMBL30842846 0.78 KMT2A (0.58) DHODHALDH1A1TDP1L3MBTL1TSHR
SCHEMBL10783794 0.78 ALDH1A1 (0.69) DHODHALDH1A1TDP1L3MBTL1TSHR

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-20230209993-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE HETEROCYCLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-29 US disclosed
US-20230180502-A1 LIGHT-EMITTING DEVICE INCLUDING DIAMINE COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE DIAMINE COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-08 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 (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-20230209993-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE HETEROCYCLIC COMPOUND CRY1, LAGE3, NQO1 DHODH 789/4885ALDH1A1 17/4885TDP1 2539/4885
US-20230180502-A1 LIGHT-EMITTING DEVICE INCLUDING DIAMINE COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE DIAMINE COMPOUND AOC1, DTD1, DDT DHODH 27/4885ALDH1A1 10/4885TDP1 969/4885

“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.