SCHEMBL21778282

SCHEMBL21778282

CC(C)(C)c1nc2ccccc2n1C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.54
GAA P10253 3/20 0.44
PSMD14 O00487 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
PARP1 P09874 1/20 0.43
MEN1 O00255 2/20 0.42
LMNA P02545 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TSHR P16473 2/20 0.42
ALDH1A1 P00352 4/20 0.42
ASAH1 Q13510 2/20 0.41
MAPT P10636 2/20 0.41
PKM P14618 2/20 0.41
MAPK1 P28482 1/20 0.41
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
HPGD P15428 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
SCHEMBL724677 0.83 ASAH1 (0.54) GAAPSMD14L3MBTL1PARP1LMNA
SCHEMBL29145180 0.81 CNR2 (0.64) CNR2GAAPSMD14L3MBTL1KMT2A
SCHEMBL18746208 0.80 SMN1; SMN2 (0.45) GAAPSMD14L3MBTL1PARP1MEN1
SCHEMBL16341726 0.80 MEN1 (0.45) GAAPSMD14L3MBTL1PARP1MEN1
SCHEMBL26300800 0.80 CNR2 (0.54) CNR2GAAPSMD14L3MBTL1PARP1
SCHEMBL21392765 0.80 L3MBTL1 (0.67) GAAPSMD14L3MBTL1NPC1RAB9A
SCHEMBL723691 0.79 PARP1 (0.54) CNR2GAAPSMD14L3MBTL1PARP1
SCHEMBL29065543 0.79 CNR2 (0.62) CNR2GAAL3MBTL1MEN1LMNA
SCHEMBL30306293 0.78 MEN1 (0.66) CNR2L3MBTL1MEN1LMNAKMT2A
SCHEMBL30306278 0.76 CNR2 (0.62) CNR2L3MBTL1MEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11424418-B2 Metal complex organic electroluminescent material and organic electroluminescent device SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2022-08-23 US disclosed
US-20200381633-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-12-03 US disclosed
US-20200144516-A1 IMIDAZOLE DERIVATIVE, MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-05-07 US disclosed
US-10577325-B2 Method for preparing a series of carbazole derivatives and use thereof in organic light-emitting diodes SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIAL CO., LTD. (CN) 2020-03-03 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-10577325-B2 Method for preparing a series of carbazole derivatives and use thereof in organic light-emitting diodes CYBA, PPOX, IK CNR2 3108/4885GAA 897/4885PSMD14 4021/4885
US-20200144516-A1 IMIDAZOLE DERIVATIVE, MATERIAL AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME ICMT, SLC19A2, NISCH CNR2 4700/4885GAA 2192/4885PSMD14 893/4885

“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.