SCHEMBL23096909

SCHEMBL23096909

C=C1/C=C\C=C/Nc2cc(C)c(C)cc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 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
SCHEMBL24279767 0.70 MAOA (0.31) —
SCHEMBL18830778 0.69 — —
SCHEMBL736129 0.58 — —
Hydrochloric Acid SCHEMBL6060731 0.56 — —
Ammonia Solution, Strong SCHEMBL28170871 0.56 — —
SCHEMBL12102414 0.56 KDM4E (0.37) KDM4EALDH1A1LMNAMAPTHPGD
Bromide SCHEMBL6060838 0.56 — —
SCHEMBL1134711 0.55 CYP3A4 (0.41) KDM4EALDH1A1LMNAMAPTHPGD
SCHEMBL28793521 0.54 — —
SCHEMBL14467552 0.53 HPGD (0.42) KDM4EALDH1A1LMNAMAPTHPGD

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
EP-3792270-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2021-03-17 — — EP disclosed
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