SCHEMBL23656380

SCHEMBL23656380

CC1N(C)c2ccccc2N1c1c(-c2ccccc2)cccc1C1CC=CCC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 1/20 0.33
▸ HTR7 P34969 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ TMEM97 Q5BJF2 1/20 0.33
▸ SIGMAR1 Q99720 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ GPR3 P46089 1/20 0.33

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
SCHEMBL23656228 0.79 KDM4E (0.41) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL23656367 0.68 ALDH1A1 (0.34) GPR3
SCHEMBL31053095 0.61 HTR2C (0.52) HTR2B
SCHEMBL29557462 0.61 HTR2C (0.52) HTR2B
SCHEMBL17952626 0.61 GABRA1 (0.40) —
SCHEMBL13783089 0.61 KDM4E (0.30) —
SCHEMBL24398363 0.61 GAA (0.44) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL16711487 0.61 GAA (0.44) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL11941264 0.61 GAA (0.44) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL13946287 0.60 KDM4E (0.41) HTR1AHTR7HTR2B

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-3851443-A1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE Samsung Electronics Co., Ltd. (KR) 2021-07-21 — — EP disclosed
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