SCHEMBL11355161

SCHEMBL11355161

O=C(Oc1c(Br)cc(Br)cc1Br)c1ccc(CBr)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 1/20 0.42
▸ CES1 P23141 1/20 0.42
▸ MAPT P10636 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ SENP1 Q9P0U3 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TTR P02766 1/20 0.38
▸ HTT P42858 3/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ CCR6 P51684 1/20 0.37
▸ HKDC1 Q2TB90 1/20 0.37

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
SCHEMBL11351332 0.86 CA1 (0.43) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL11346502 0.84 THRA (0.47) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL9174491 0.77 HSD17B10 (0.43) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL11662582 0.77 THRA (0.43) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL3536109 0.77 CES2 (0.44) CES2CES1MAPTKMT2AMEN1
SCHEMBL11658518 0.77 MAPT (0.40) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL9173276 0.76 HTT (0.47) MAPTKMT2AMEN1ALDH1A1HPGD
SCHEMBL636176 0.73 CES2 (0.55) CES2CES1MAPTKMT2AMEN1
SCHEMBL2500365 0.73 CES2 (0.55) CES2CES1MAPTKMT2AMEN1
SCHEMBL8983809 0.71 CES2 (0.59) CES2CES1MAPTKMT2AMEN1

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
US-4260803-A FIREPROOFING, HERBICIDES, FUNGICIDES DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1981-04-07 — — US disclosed
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