SCHEMBL23656228

SCHEMBL23656228

CC1N(C)c2ccccc2N1c1c(-c2ccccc2)cccc1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ GPR3 P46089 1/20 0.39
▸ MGLL Q99685 1/20 0.35
▸ HTR1A P08908 2/20 0.33
▸ HTR7 P34969 2/20 0.33
▸ GABRA1 P14867 2/20 0.33
▸ GABRG2 P18507 2/20 0.33
▸ GABRB3 P28472 2/20 0.33
▸ GABRA5 P31644 2/20 0.33
▸ GABRA3 P34903 2/20 0.33
▸ GABRA2 P47869 2/20 0.33
▸ GABRB2 P47870 2/20 0.33
▸ GABRP O00591 1/20 0.33
▸ GABRD O14764 1/20 0.33
▸ GABRB1 P18505 1/20 0.33
▸ GABRA4 P48169 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
SCHEMBL23656367 0.86 ALDH1A1 (0.34) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL23656380 0.79 HTR1A (0.33) GPR3HTR1AHTR7HTR2BTMEM97
SCHEMBL17169592 0.76 CYP17A1 (0.43) KDM4EALDH1A1HPGD
SCHEMBL17952626 0.75 GABRA1 (0.40) ALDH1A1GABRA1GABRG2GABRB3GABRA5
SCHEMBL16711487 0.74 GAA (0.44) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL11941264 0.74 GAA (0.44) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL24398363 0.74 GAA (0.44) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL17169568 0.74 CYP17A1 (0.34) ALDH1A1HTR7GABRA1GABRG2GABRB3
SCHEMBL17952189 0.73 CYP1A2 (0.38) KDM4EALDH1A1GAAHPGDGABRA1
SCHEMBL17952527 0.73 SMN1; SMN2 (0.37) KDM4EALDH1A1GAAHPGDHTR1A

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-3851443-B1 ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING ORGANOMETALLIC COMPOUND, AND ELECTRONIC APPARATUS INCLUDING ORGANIC LIGHT-EMITTING DEVICE SAMSUNG ELECTRONICS CO LTD (KR) 2023-09-13 — — EP disclosed
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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