SCHEMBL8673233

SCHEMBL8673233

Oc1c(Br)cc(C(c2ccccc2)(c2ccccc2)c2cc(Br)c(O)c(Br)c2)cc1Br

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.54
CRHR2 Q13324 1/20 0.54
TSHR P16473 3/20 0.50
HIF1A Q16665 3/20 0.50
ALOX15 P16050 2/20 0.50
ALOX12 P18054 2/20 0.50
CYP3A4 P08684 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
HSD17B10 Q99714 2/20 0.50
ALDH1A1 P00352 2/20 0.50
HPGD P15428 1/20 0.50
CASP1 P29466 1/20 0.50
RECQL P46063 1/20 0.50
CYP2C9 P11712 2/20 0.41
TTR P02766 2/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
GFER P55789 1/20 0.40

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
SCHEMBL5990792 1.00 CRHBP (0.54) CRHBPCRHR2TSHRHIF1AALOX15
SCHEMBL8676214 0.79 ALOX15 (0.50) CRHBPCRHR2TSHRHIF1AALOX15
SCHEMBL27546691 0.79 ALOX15 (0.50) CRHBPCRHR2TSHRHIF1AALOX15
SCHEMBL8623383 0.79 CYP3A4 (0.76) CRHBPCRHR2TSHRHIF1AALOX15
SCHEMBL9682952 0.79 ALDH1A1 (0.57) CRHBPCRHR2TSHRHIF1AALOX15
SCHEMBL24174896 0.78 GAA (0.42) TSHRHIF1ATDP1ALDH1A1MAPT
SCHEMBL26624383 0.78 TSHR (0.37) CRHBPCRHR2TSHRTDP1ALDH1A1
SCHEMBL23861355 0.77 ESR1 (0.39) HIF1AALOX15CYP3A4TDP1HSD17B10
SCHEMBL4601584 0.76 PTGS1 (0.50) ALOX15CYP3A4ALDH1A1CYP2C9TTR
SCHEMBL25708111 0.75 ALDH1A1 (0.41) TSHRTDP1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5777009-A Flame retardant low Tg polyestercarbonate GENERAL ELECTRIC COMPANY (US) 1998-07-07 US disclosed
EP-0838503-A1 Flame retardant composition of polyerstercarbonate, halogenated polycarbonate, potassium diphenylsulfone sulfonate and polytetrafluoroethylene GENERAL ELECTRIC COMPANY (US) 1998-04-29 EP disclosed
EP-0563316-B1 POLYOXAZOLIDONES FULLER H B LICENSING FINANC (US) 1995-03-08 EP disclosed
EP-0563316-A1 POLYOXAZOLIDONES. FULLER H B LICENSING FINANC (US) 1993-10-06 EP disclosed
US-5138016-A Using zinc halide catalyst H. B. FULLER COMPANY (US) 1992-08-11 US disclosed
WO-1992011304-A1 NOVEL CATALYST FOR PRODUCTION OF OXAZOLIDINE COMPOUNDS H.B. FULLER LICENSING & FINANCING INC. (US) 1992-07-09 WO disclosed
US-4766158-A CATALYTIC REACTION OF POLYISOCYANATES AND POLYEPOXIDE OLIN CORPORATION (US) 1988-08-23 US disclosed
US-4699931-A REACTING POLYISOCYANATE WITH POLYEPOXIDE-THERMAL STABILITY OLIN CORPORATION (US) 1987-10-13 US disclosed
US-4412012-A CURING AGENT IS KETONE BLOCKED PRIMARY AMINE ALBANY INTERNATIONAL CORP. (US) 1983-10-25 US disclosed
US-4410639-A KETONE BLOCKED PRIMARY AMINE CURING AGENT ALBANY INTERNATIONAL CORP. (US) 1983-10-18 US disclosed
US-4066628-A REACTING ORGANIC ISOCYANATE WITH AN EPOXIDE MITSUBISHI CHEMICAL INDUSTRIES LTD. (JA) 1978-01-03 US disclosed