SCHEMBL8372180

SCHEMBL8372180

O=C(Oc1c(Br)ccc(Br)c1C(=O)O)c1cc(C(=O)Oc2c(Br)ccc(Br)c2C(=O)O)cc(C(=O)Oc2c(Br)ccc(Br)c2C(=O)O)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.35
▸ POLA1 P09884 1/20 0.35
▸ ANTXR2 P58335 1/20 0.35
▸ NSD2 O96028 1/20 0.35
▸ TTR P02766 1/20 0.34
▸ TPMT P51580 1/20 0.34
▸ MAPT P10636 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ CRHBP P24387 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ CRHR2 Q13324 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ CA12 O43570 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
SCHEMBL30474626 0.71 CA12 (0.43) TTRKMT2AALDH1A1KDM4EHSD17B10
SCHEMBL10415958 0.71 CA12 (0.43) TTRKMT2AALDH1A1KDM4EHSD17B10
SCHEMBL8375398 0.70 HSD17B10 (0.62) POLBPOLA1ANTXR2TPMTMAPT
SCHEMBL18263212 0.68 LMNA (0.50) MAPTKMT2ACRHBPHTTCRHR2
SCHEMBL8044565 0.67 HSD17B10 (0.57) POLBPOLA1ANTXR2TPMTMAPT
SCHEMBL9174491 0.66 HSD17B10 (0.43) TTRTPMTMAPTKMT2ACRHBP
SCHEMBL421547 0.66 MAPT (0.51) TPMTMAPTKMT2AHTTALDH1A1
SCHEMBL6930173 0.66 HSD17B10 (0.51) POLBTPMTMAPTALDH1A1KDM4E
SCHEMBL6939130 0.66 MAPT (0.47) POLBMAPTKMT2ACRHBPHTT
SCHEMBL9173276 0.66 HTT (0.47) POLBMAPTKMT2ACRHBPHTT

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-0669940-B1 SPECIFICALLY CROSSLINKED HEMOGLOBIN WITH FREE FUNCTIONALITY UNIV TORONTO (CA) 1999-02-10 — — EP claimed
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