SCHEMBL22369532

SCHEMBL22369532

CCCCC(CC)n1c2ccc(Br)cc2c2cc(-c3ccc(C)cc3)ccc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ICMT O60725 8/20 0.40
▸ DNM1 Q05193 4/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ HCRTR2 O43614 2/20 0.32
▸ PGR P06401 1/20 0.31
▸ RORA P35398 1/20 0.31
▸ RORC P51449 1/20 0.31
▸ RORB Q92753 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ NPSR1 Q6W5P4 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
SCHEMBL673712 0.84 DNM1 (0.38) DNM1SIGMAR1MAPTSMN1; SMN2
SCHEMBL17912279 0.79 TSPO (0.43) DNM1MAPTALDH1A1MAPK1HTT
SCHEMBL14680674 0.77 OXER1 (0.40) DNM1SIGMAR1MAPTSMN1; SMN2
SCHEMBL28155228 0.73 OXER1 (0.33) SMN1; SMN2HTT
SCHEMBL17578546 0.72 OXER1 (0.35) —
SCHEMBL20685564 0.72 MEN1 (0.40) MAPTSMN1; SMN2RORARORCRORB
SCHEMBL19896301 0.71 OXER1 (0.33) DNM1SIGMAR1MAPTSMN1; SMN2ALDH1A1
SCHEMBL20018474 0.70 DNM1 (0.46) DNM1SIGMAR1MAPTSMN1; SMN2PGR
SCHEMBL31225137 0.70 DNM1 (0.37) DNM1SIGMAR1MAPTSMN1; SMN2HTT
SCHEMBL4811708 0.68 CNR1 (0.32) —

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-3699231-B1 NOVEL POLYMER AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME LG CHEMICAL LTD (KR) 2021-07-21 — — EP disclosed
EP-3699231-A1 NOVEL POLYMER AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-08-26 — — EP disclosed
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