SCHEMBL31005175

SCHEMBL31005175

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc4cc(-c5nc(-c6ccccc6)nc(-c6ccc(C78CC9CC(CC(C9)C7)C8)cc6)n5)ccc4c3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.54
▸ ALDH1A1 P00352 5/20 0.47
▸ LMNA P02545 3/20 0.47
▸ MEN1 O00255 7/20 0.43
▸ KMT2A Q03164 7/20 0.43
▸ RARB P10826 5/20 0.43
▸ RARG P13631 5/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ RARA P10276 3/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ THRB P10828 1/20 0.42
▸ RECQL P46063 1/20 0.42

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
SCHEMBL31005179 0.95 HTT (0.49) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL31005177 0.93 HTT (0.55) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL31005173 0.93 HTT (0.55) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL25709063 0.92 HTT (0.60) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL31074776 0.92 HTT (0.60) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL31005162 0.91 HTT (0.54) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL31005184 0.91 HTT (0.54) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL25710150 0.91 HTT (0.59) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL18317610 0.90 HTT (0.52) HTTALDH1A1LMNAMEN1KMT2A
SCHEMBL25709076 0.89 PGR (0.44) HTTALDH1A1LMNAMEN1KMT2A

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-20240292743-A1 LIGHT-EMITTING DEVICE INCLUDING HETEROCYCLIC COMPOUND, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND THE HETEROCYCLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2024-08-29 — — US disclosed
CN-118459415-A Heterocyclic compound, light-emitting device, electronic apparatus, and electronic device 三星显示有限公司 2024-08-09 — — CN disclosed
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