SCHEMBL26433462

SCHEMBL26433462

C=C/C(=C\C=C(C)C)Nc1ccc(C)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.46
▸ POLB P06746 1/20 0.40
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ NMT1 P30419 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ DDAH1 O94760 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ KIF11 P52732 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ HPGD P15428 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
SCHEMBL14402892 0.84 TGM2 (0.48) TGM2POLBNPC1RAB9AMAPT
SCHEMBL25769933 0.77 TGM2 (0.47) TGM2TDP1POLBNPC1RAB9A
SCHEMBL20912080 0.70 TGM2 (0.47) TGM2TDP1POLBNPC1RAB9A
SCHEMBL648950 0.69 TGM2 (1.00) TGM2TDP1POLBNPC1RAB9A
SCHEMBL24862879 0.69 NPC1 (0.40) TGM2NPC1RAB9AMAPTKIF11
SCHEMBL24679668 0.68 PTPN1 (0.42) TGM2POLBNPC1RAB9AMAPT
SCHEMBL19216109 0.68 ALDH1A1 (0.38) TGM2TDP1NPC1RAB9AMAPT
SCHEMBL14017499 0.68 TGM2 (0.49) TGM2TDP1POLBNPC1RAB9A
SCHEMBL10057892 0.68 TDP1 (0.60) TGM2TDP1POLBNPC1RAB9A
SCHEMBL1454275 0.67 TDP1 (0.65) TGM2TDP1POLBNPC1RAB9A

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-4174055-A1 LIGHT EMITTING DEVICE AND AMINE COMPOUND FOR LIGHT EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2023-05-03 — — EP disclosed
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