SCHEMBL18318014

SCHEMBL18318014

C=C(C)COc1nc(OCC(=C)C)nc(OCC2CO2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.41
▸ GLA P06280 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ TSHR P16473 4/20 0.35
▸ TP53 P04637 3/20 0.35
▸ HIF1A Q16665 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ PPARG P37231 1/20 0.35
▸ PKM P14618 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ VDR P11473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CDK1 P06493 1/20 0.30

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
SCHEMBL11178320 1.00 ALDH1A1 (0.41) ALDH1A1GLATDP1TSHRTP53
SCHEMBL29398866 0.82 TDP1 (0.48) ALDH1A1GLATDP1TSHRTP53
SCHEMBL29397562 0.82 TDP1 (0.48) ALDH1A1GLATDP1TSHRTP53
SCHEMBL487480 0.82 TDP1 (0.48) ALDH1A1GLATDP1TSHRTP53
SCHEMBL2487338 0.80 CDK1 (0.39) ALDH1A1TDP1TSHRTP53SMN1; SMN2
SCHEMBL3677603 0.78 TDP1 (0.42) ALDH1A1GLATDP1TSHRTP53
SCHEMBL11213546 0.77 ALDH1A1 (0.42) ALDH1A1GLATDP1TSHRTP53
SCHEMBL26752852 0.77 ALDH1A1 (0.46) ALDH1A1GLATDP1TSHRTP53
SCHEMBL9629414 0.77 ALDH1A1 (0.57) ALDH1A1GLATDP1TSHRTP53
SCHEMBL11329118 0.77 CDK1 (0.30) CDK1CCNB1MGMTCCNA2CDK2

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
US-10454008-B2 Resin composition, reflector, lead frame with reflector, and semiconductor light-emitting device DAI NIPPON PRINTING CO., LTD. (JP) 2019-10-22 — — US disclosed
US-20160372645-A1 RESIN COMPOSITION, REFLECTOR, LEAD FRAME WITH REFLECTOR, AND SEMICONDUCTOR LIGHT-EMITTING DEVICE DAI NIPPON PRINTING CO., LTD. (JP) 2016-12-22 — — US disclosed
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