SCHEMBL9646424

SCHEMBL9646424

O=C(O)COc1c(Br)cccc1Br

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.66
▸ CD69 Q07108 4/20 0.58
▸ ALOX15 P16050 2/20 0.52
▸ TSHR P16473 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ PTPN1 P18031 3/20 0.47
▸ PTPRC P08575 1/20 0.47
▸ PTPN2 P17706 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ THRB P10828 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HIF1A Q16665 1/20 0.44

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
SCHEMBL2561402 0.84 PTGDR2 (0.57) KMT2ACD69ALOX15TSHRHSD17B10
SCHEMBL4483469 0.82 ALDH1A1 (0.49) KMT2ACD69HSD17B10PKMKDM4E
SCHEMBL23980841 0.81 NPC1 (0.50) KMT2AALOX15PTPN1KDM4EALDH1A1
SCHEMBL3729436 0.79 KMT2A (1.00) KMT2ACD69ALOX15PKMLMNA
SCHEMBL8954486 0.79 AKR1B1 (0.57) KMT2AALOX15TSHRHSD17B10PTPN1
SCHEMBL23273092 0.79 KMT2A (0.42) KMT2ACD69ALOX15TSHRHSD17B10
SCHEMBL3241147 0.78 PKM (0.64) KMT2AALOX15PKMLMNAKDM4E
SCHEMBL1145948 0.77 KMT2A (0.62) KMT2ACD69ALOX15HSD17B10PKM
SCHEMBL6746937 0.76 THRB (0.54) KMT2AALOX15TSHRHSD17B10PKM
SCHEMBL2014943 0.76 KMT2A (0.61) KMT2ACD69ALOX15LMNAKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0257011-B1 PERMEATION MODIFIED ASYMMETRIC GAS SEPARATION MEMBRANES HAVING GRADED DENSITY SKINS PERMEA, Inc. (US) 1992-10-07 — — EP disclosed
US-4728346-A PERMSELECTIVITY PERMEA INC. (US) 1988-03-01 — — US disclosed
EP-0257011-A2 Permeation modified asymmetric gas separation membranes having graded density skins PERMEA, Inc. (US) 1988-02-24 — — EP disclosed
US-4575385-A POLYSULFONES CONTACTED WITH BENZENE COMPOUND MONSANTO COMPANY (US) 1986-03-11 — — US disclosed
Send feedback