SCHEMBL20830771

SCHEMBL20830771

CCc1cc(COC2CCCCO2)c(C)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ CREBBP Q92793 2/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ NPC1 O15118 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TAS1R3 Q7RTX0 1/20 0.32
▸ TAS1R1 Q7RTX1 1/20 0.32
▸ EP300 Q09472 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ICAM1 P05362 1/20 0.32
▸ SELE P16581 1/20 0.32
▸ GRIN1 Q05586 2/20 0.31

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
SCHEMBL24874173 0.88 KDM4C (0.36) MEN1KMT2ACREBBPKDM4CNPC1
SCHEMBL17094748 0.85 KDM4C (0.34) MEN1KMT2ACREBBPKDM4CNPC1
SCHEMBL15365454 0.80 KMT2A (0.36) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL17094660 0.78 KDM4C (0.30) KDM4CNPC1RAB9A
SCHEMBL18355473 0.77 L3MBTL1 (0.38) MEN1KMT2ACREBBPKDM4CNPC1
SCHEMBL5522712 0.76 KDM4C (0.37) KDM4CNPC1RAB9AMAPTALDH1A1
SCHEMBL30452411 0.74 KDM4C (0.38) MEN1KMT2ACREBBPKDM4CNPC1
SCHEMBL24252783 0.74 KDM4C (0.38) MEN1KMT2ACREBBPKDM4CNPC1
SCHEMBL14650390 0.74 KDM4C (0.38) MEN1KMT2ACREBBPKDM4CNPC1
SCHEMBL18355699 0.74 TACR1 (0.46) MEN1KMT2ACREBBPKDM4CNPC1

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-3456713-A1 PROCESS FOR THE PREPARATION OF TRIAZINE DERIVATIVES Japan Tobacco Inc. (JP) 2019-03-20 — — EP disclosed
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