SCHEMBL25753536

SCHEMBL25753536

Cc1cc(C(=O)OCc2ccccc2)nn1C(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.51
MAPT P10636 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
KMT2A Q03164 1/20 0.46
P2RX4 Q99571 2/20 0.45
ALDH1A1 P00352 3/20 0.44
P2RX1 P51575 1/20 0.44
P2RX3 P56373 1/20 0.44
JMJD6 Q6NYC1 1/20 0.44
LMNA P02545 1/20 0.43
KDM4E B2RXH2 2/20 0.43
MAOB P27338 2/20 0.43
ADORA2A P29274 2/20 0.43
POLB P06746 1/20 0.43
HTR2C P28335 1/20 0.42
CTRB1 P17538 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL19492477 0.85 TDP1 (0.47) TDP1MAPTL3MBTL1SLC6A2SLC6A3
SCHEMBL22825569 0.85 L3MBTL1 (0.57) TDP1MAPTL3MBTL1ALDH1A1LMNA
SCHEMBL22005632 0.83 TDP1 (0.53) TDP1MAPTL3MBTL1SLC6A2SLC6A3
SCHEMBL22826520 0.80 ALDH1A1 (0.44) TDP1MAPTL3MBTL1KMT2AALDH1A1
SCHEMBL23021326 0.79 PDK1 (0.42) TDP1MAPTL3MBTL1SLC6A2SLC6A3
SCHEMBL24423706 0.78 ALDH1A1 (0.47) TDP1MAPTL3MBTL1SLC6A2SLC6A3
SCHEMBL25337 0.78 MAPT (0.43) TDP1MAPTL3MBTL1SLC6A2SLC6A3
SCHEMBL26924634 0.77 L3MBTL1 (0.49) TDP1MAPTL3MBTL1KMT2AALDH1A1
SCHEMBL20154213 0.76 ADORA3 (0.47) TDP1MAPTL3MBTL1SLC6A2SLC6A3
SCHEMBL20154179 0.76 MAPT (0.49) TDP1MAPTL3MBTL1SLC6A2SLC6A3

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-11691957-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-04 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-11691957-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CCNT1, CCNA1 TDP1 3145/4885MAPT 1322/4885L3MBTL1 199/4885

“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.