SCHEMBL25525245

SCHEMBL25525245

C1=C(c2ccc3c(ccc4ccccc43)c2)C=C(c2ccc(-c3ccccc3)cc2)NC1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33
▸ ESR1 P03372 1/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ HPRT1 P00492 1/20 0.32
▸ HTR6 P50406 2/20 0.31
▸ CYP2A6 P11509 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL23479426 0.78 KDM4E (0.42) ALDH1A1
SCHEMBL23478859 0.78 KDM4E (0.42) ALDH1A1
SCHEMBL23478872 0.78 KDM4E (0.43) ALDH1A1TDP1
SCHEMBL20080324 0.77 HPGDS (0.35) —
SCHEMBL23478810 0.77 GPR84 (0.31) —
SCHEMBL19622899 0.76 KDM4E (0.42) ALDH1A1HSD17B10CYP2A6
SCHEMBL20080289 0.76 ESR1 (0.34) ESR1ESR2
SCHEMBL19070934 0.76 — —
SCHEMBL23478976 0.76 KDM4E (0.35) ALDH1A1
SCHEMBL23478885 0.76 KDM4E (0.42) ALDH1A1TDP1

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
EP-4225006-A2 ORGANIC LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2023-08-09 — — EP disclosed
EP-3246963-B1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO LTD (KR) 2023-05-31 — — EP disclosed
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