SCHEMBL20630255

SCHEMBL20630255

C/C=C\C=C(/C=C\C)Nc1cccc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ RAB9A P51151 5/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ CYP1A2 P05177 2/20 0.43
▸ CYP2C19 P33261 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ MAPT P10636 4/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ EPHX1 P07099 1/20 0.41
▸ GRIN2D O15399 1/20 0.40
▸ GRIN3B O60391 1/20 0.40
▸ GRIN1 Q05586 1/20 0.40

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
SCHEMBL20412292 0.87 GAA (0.51) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL19984680 0.87 KMT2A (0.46) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL26405330 0.81 KMT2A (0.54) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL24004141 0.78 GAA (0.51) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL27401064 0.76 KMT2A (0.47) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL24450112 0.74 TAS2R38 (0.39) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL13514968 0.74 TAS2R38 (0.39) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL24004239 0.72 KMT2A (0.60) GAAKDM4ERAB9AKMT2ANPC1
SCHEMBL11114285 0.70 KDM4E (0.65) GAAKDM4ERAB9AKMT2ANPC1
Sorbic Acid SCHEMBL1656122 0.68 RAB9A (0.44) GAAKDM4ERAB9AKMT2ANPC1

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-3425032-B1 LUBRICATING OIL COMPOSITION IDEMITSU KOSAN CO (JP) 2021-01-27 — — EP disclosed
EP-3425032-A1 LUBRICATING OIL COMPOSITION Idemitsu Kosan Co., Ltd. (JP) 2019-01-09 — — EP disclosed
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