SCHEMBL21864313

SCHEMBL21864313

C=C(C)c1ccnc(-c2ccccc2C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 2/20 0.49
▸ SMYD2 Q9NRG4 1/20 0.46
▸ CYP1A2 P05177 11/20 0.43
▸ CYP2C19 P33261 8/20 0.43
▸ CYP2D6 P10635 7/20 0.43
▸ CYP3A4 P08684 6/20 0.43
▸ CLK4 Q9HAZ1 4/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ TGFBR1 P36897 1/20 0.43
▸ FFAR1 O14842 1/20 0.41
▸ MAPK1 P28482 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ MITF O75030 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PKM P14618 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
SCHEMBL9473584 0.82 KDM4C (0.54) KDM4CSMYD2CYP1A2CYP2C19CYP2D6
SCHEMBL21310984 0.81 KDM4C (0.68) KDM4CSMYD2FFAR1KDM4EKDM6B
SCHEMBL30775344 0.81 KDM4C (0.68) KDM4CSMYD2FFAR1KDM4EKDM6B
SCHEMBL2335933 0.79 KDM4C (0.51) KDM4CSMYD2CYP1A2CYP2C19CYP2D6
SCHEMBL14053980 0.78 ASIC3 (0.50) KDM4CALDH1A1NPC1RAB9AL3MBTL1
SCHEMBL28490524 0.77 KDM4C (0.61) KDM4CSMYD2CYP1A2CYP2C19CYP2D6
Nitrous Acid SCHEMBL29163839 0.76 KDM4C (0.62) KDM4CSMYD2FFAR1KDM4EKDM6B
SCHEMBL987521 0.75 CCR1 (0.61) SMYD2CYP1A2CYP2C19CYP2D6CYP3A4
SCHEMBL18888856 0.74 PLA2G7 (0.51) CYP1A2CYP2C19CYP2D6CLK4HSD17B10
SCHEMBL14655743 0.74 ALOX5 (0.45) KDM4CCYP2C19NPC1TSHRMAPT

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-3637490-A1 HIGH EFFICIENCY YELLOW LIGHT EMITTERS FOR OLED DEVICES Universal Display Corporation (US) 2020-04-15 — — EP disclosed
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