SCHEMBL29341879

SCHEMBL29341879

C=c1ccccc(=C)c(-c2cccc3c2C=CC(C)C=C3)c2c(c1-c1ccc(-c3ccc4ccccc4c3)cc1)C=CC(C)C=C2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ SLC6A3 Q01959 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32
▸ HSD17B1 P14061 1/20 0.32
▸ HSD17B2 P37059 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ GSTP1 P09211 1/20 0.31
▸ CTRC Q99895 1/20 0.30

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
SCHEMBL29324955 0.86 PIM1 (0.38) SLC6A2SLC6A4SLC6A3HDAC4HDAC2
SCHEMBL29324467 0.77 — —
SCHEMBL29324545 0.77 — —
SCHEMBL29324582 0.69 TERT (0.31) —
SCHEMBL5048952 0.63 CYP2A6 (0.65) ESR1ESR2HSD17B1HSD17B2ALDH1A1
SCHEMBL26316268 0.63 DHFR (0.36) ALDH1A1CYP1A2HPGDTSHRSMN1; SMN2
SCHEMBL2775233 0.62 ESR1 (0.47) ESR1ESR2HDAC4HDAC2HDAC8
SCHEMBL29360710 0.62 ESR1 (0.47) ESR1ESR2HDAC4HDAC2HDAC8
SCHEMBL29629004 0.62 TDP1 (0.58) ESR1ESR2HSD17B1HSD17B2ALDH1A1
SCHEMBL28030821 0.61 GSTP1 (0.46) ESR1ESR2SLC6A2SLC6A4SLC6A3

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-20240244971-A1 ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2024-07-18 — — US disclosed
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