SCHEMBL27737399

SCHEMBL27737399

[c]1ccc(-c2c3ccccc3nc3ccccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 7/20 0.56
▸ ESR2 Q92731 6/20 0.56
▸ MAPT P10636 6/20 0.47
▸ ALDH1A1 P00352 5/20 0.47
▸ KDM4E B2RXH2 5/20 0.47
▸ LMNA P02545 4/20 0.47
▸ HPGD P15428 3/20 0.47
▸ HSD17B10 Q99714 3/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ GLA P06280 3/20 0.47
▸ POLB P06746 3/20 0.47
▸ CASP1 P29466 2/20 0.47
▸ CASP7 P55210 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ GAA P10253 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ HTT P42858 1/20 0.47
▸ RAD52 P43351 1/20 0.47

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
SCHEMBL194068 0.84 ESR1 (0.73) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL29514776 0.84 ESR1 (0.73) ESR1ESR2MAPTALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL28289396 0.82 ESR1 (0.70) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL3740207 0.82 ACHE (0.45) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL28139140 0.82 ESR1 (0.70) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL26462184 0.80 ESR1 (0.68) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL28586210 0.79 ESR1 (0.51) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL714185 0.78 LMNA (0.47) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL13382357 0.78 ESR1 (0.64) ESR1ESR2MAPTALDH1A1KDM4E
SCHEMBL29488279 0.77 ESR1 (0.58) ESR1ESR2MAPTALDH1A1KDM4E

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
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 — — CN disclosed
CN-101423757-A High performance electroluminescent organic material and application thereof in organic EL device UNIV JILIN (CN) 2009-05-06 — — CN disclosed
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