SCHEMBL24522083

SCHEMBL24522083

C=c1/c(=C\CCC)c2ccccc2n1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 1/20 0.42
▸ KDM4E B2RXH2 5/20 0.40
▸ HTT P42858 3/20 0.40
▸ TSHR P16473 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ SLC2A1 P11166 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ NQO2 P16083 1/20 0.37
▸ PGR P06401 2/20 0.36
▸ RORA P35398 1/20 0.36
▸ RORC P51449 1/20 0.36
▸ RORB Q92753 1/20 0.36
▸ NPEPPS P55786 1/20 0.36
▸ ERCC1 P07992 1/20 0.36
▸ FEN1 P39748 1/20 0.36
▸ ERCC4 Q92889 1/20 0.36

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
SCHEMBL24538589 0.78 GPR3 (0.50) GPR3KDM4EHTTALDH1A1LMNA
SCHEMBL23625525 0.75 GPR3 (0.47) GPR3KDM4EHTTTSHRALDH1A1
SCHEMBL18830840 0.72 GPR3 (0.44) GPR3KDM4EHTTTSHRALDH1A1
SCHEMBL24050350 0.69 GPR3 (0.58) GPR3KDM4EHTTALDH1A1LMNA
SCHEMBL14539740 0.65 MAPT (0.36) GPR3KDM4ETSHRALDH1A1LMNA
SCHEMBL8007911 0.63 GPR3 (0.45) GPR3KDM4EHTTTSHRALDH1A1
SCHEMBL8007913 0.63 GPR3 (0.45) GPR3KDM4EHTTTSHRALDH1A1
SCHEMBL29321 0.63 GPR3 (1.00) GPR3KDM4EHTTALDH1A1LMNA
SCHEMBL29461528 0.63 GPR3 (1.00) GPR3KDM4EHTTALDH1A1LMNA
SCHEMBL25608293 0.62 GPR3 (0.48) GPR3KDM4EHTTALDH1A1LMNA

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-4027400-A1 ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2022-07-13 — — EP disclosed
EP-4016659-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2022-06-22 — — EP disclosed
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