SCHEMBL28337678

SCHEMBL28337678

O=C(O)Oc1c(Br)cccc1Br

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRNP P04156 1/20 0.36
▸ KMT2A Q03164 5/20 0.34
▸ MEN1 O00255 3/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ HSD11B1 P28845 1/20 0.33
▸ TUBB4A P04350 1/20 0.33
▸ TUBB P07437 1/20 0.33
▸ TUBA3C P0DPH7 1/20 0.33
▸ TUBA1B P68363 1/20 0.33

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
SCHEMBL28337676 0.83 HSD17B10 (0.35) PRNPKMT2AMEN1USP2MAPT
SCHEMBL9646427 0.79 KDM4E (0.48) KMT2AMEN1LMNAHTTMAPT
SCHEMBL18263212 0.79 LMNA (0.50) KMT2AMEN1LMNAHTTUSP2
SCHEMBL7119836 0.76 HSD17B10 (0.52) KMT2AMEN1LMNAMAPTHSD17B10
SCHEMBL11411081 0.76 KMT2A (0.38) PRNPKMT2AMEN1NPC1RAB9A
SCHEMBL31389161 0.76 KMT2A (0.38) PRNPKMT2AMEN1NPC1RAB9A
SCHEMBL57100 0.74 KMT2A (0.44) KMT2AMEN1NPC1LMNAHTT
SCHEMBL30410456 0.74 THRB (0.40) KMT2AMEN1LMNAMAPTALDH1A1
SCHEMBL18272061 0.74 ELANE (0.47) —
SCHEMBL1728306 0.73 MAPK1 (0.47) KMT2AMEN1USP2MAPTALDH1A1

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
CN-107108416-B Preparation method of 1, 2-dicyclopropylethylphenol and optical isomer thereof 四川海思科制药有限公司 2019-12-20 — — CN disclosed
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