SCHEMBL21563899

SCHEMBL21563899

C=C(/C=C\C(=C/C)N(c1ccc(N(c2ccccc2)c2cccc(C)c2)cc1)c1ccc(N(c2ccccc2)c2cccc(C)c2)cc1)N(c1ccccc1)c1cccc(C)c1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 3/20 0.33
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TRPM8 Q7Z2W7 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ HPGD P15428 2/20 0.31
▸ ALOX15 P16050 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ SLC6A2 P23975 1/20 0.30
▸ SLC6A4 P31645 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
SCHEMBL18884629 1.00 PTGIR (0.33) PTGIRCYP3A4CYP2C9CYP2C19TRPM8
SCHEMBL23544437 0.88 PTGIR (0.34) PTGIRCYP3A4CYP2C9CYP2C19TRPM8
SCHEMBL19427200 0.85 PTGIR (0.33) PTGIRCYP3A4CYP2C9CYP2C19TRPM8
SCHEMBL13709429 0.85 ALDH1A1 (0.36) ALDH1A1HTT
SCHEMBL17246801 0.84 CYP3A4 (0.33) PTGIRCYP3A4CYP2C9CYP2C19TRPM8
SCHEMBL22780756 0.84 HSD17B1 (0.36) PTGIRCYP3A4CYP2C9CYP2C19TRPM8
SCHEMBL12957651 0.82 HSD17B1 (0.33) PTGIRCYP3A4CYP2C9CYP2C19TRPM8
SCHEMBL15393671 0.81 TRPM8 (0.40) PTGIRTRPM8ALDH1A1NPC1JAK2
SCHEMBL18786358 0.80 TRPM8 (0.32) PTGIRCYP3A4CYP2C9CYP2C19TRPM8
SCHEMBL23187317 0.80 — —

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11322693-B2 Organic light-emitting element, and light-emitting material and fluorescent body used in same KYUSHU UNIVERSITY NATIONAL UNIVERSITY CORPORATION (JP) 2022-05-03 — — US disclosed
EP-3800679-B1 ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO LTD (KR) 2022-01-26 — — EP disclosed
US-20190348617-A1 ORGANIC LIGHT-EMITTING ELEMENT, AND LIGHT-EMITTING MATERIAL AND FLUORESCENT BODY USED IN SAME KYUSHU UNIVERSITY NATIONAL UNIVERSITY CORPORATION (JP) 2019-11-14 — — US disclosed
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