SCHEMBL25858315

SCHEMBL25858315

CC1(C)c2ccc(Nc3ccccc3-c3cccc4ccccc34)cc2-c2c(-c3ccccc3-c3ccc4ccccc4c3)cccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.34
▸ PIM1 P11309 2/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ FADS1 O60427 1/20 0.33
▸ MAPK14 Q16539 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CDC25B P30305 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PTGER3 P43115 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31

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
SCHEMBL25125371 0.90 ADORA2A (0.34) ALDH1A1MAPTHDAC4HDAC2HDAC8
SCHEMBL25858314 0.86 ALDH1A1 (0.38) ALDH1A1MAPTRAB9AFADS1MAPK14
SCHEMBL24890009 0.83 FADS1 (0.40) ALDH1A1MAPTRAB9AFADS1MAPK14
SCHEMBL24432376 0.80 ALDH1A1 (0.35) ALDH1A1MAPTRAB9AHDAC4HDAC2
SCHEMBL25125253 0.79 FADS1 (0.37) ALDH1A1MAPTRAB9AFADS1MAPK14
SCHEMBL27012267 0.79 ALDH1A1 (0.36) ALDH1A1MAPTPIM1HDAC8SLC6A2
SCHEMBL25124788 0.79 CDC25B (0.38) ALDH1A1MAPTRAB9AFADS1MAPK14
SCHEMBL19089973 0.79 FADS1 (0.40) ALDH1A1MAPTRAB9AFADS1MAPK14
SCHEMBL24969752 0.78 ALDH1A1 (0.43) ALDH1A1MAPTCYP3A4HPGDHSD17B10
SCHEMBL19089835 0.78 SLC6A2 (0.37) ALDH1A1MAPTRAB9APIM1HDAC4

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
US-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 — — US disclosed
US-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 — — US disclosed
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