SCHEMBL6816385

SCHEMBL6816385

OC(c1ccc2cc3cc(C(O)(C(F)(F)F)C(F)(F)F)ccc3cc2c1)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ NR1H2 P55055 9/20 0.47
▸ NR1H3 Q13133 9/20 0.47
▸ PTPN1 P18031 4/20 0.44
▸ RORA P35398 1/20 0.42
▸ RORC P51449 1/20 0.42
▸ MLYCD O95822 1/20 0.41
▸ PGR P06401 1/20 0.40
▸ SMN1; SMN2 Q16637 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
SCHEMBL6816283 0.95 NR1H2 (0.50) ARMEN1ALOX15TSHRMAPK1
SCHEMBL7255062 0.87 PTPN1 (0.56) ARMEN1ALOX15TSHRMAPK1
SCHEMBL131990 0.77 NR1H2 (0.68) NR1H2NR1H3MLYCDSMN1; SMN2
SCHEMBL12895889 0.75 BACE1 (0.52) MEN1TSHRMAPK1KMT2APTPN1
SCHEMBL12895896 0.75 BACE1 (0.52) MEN1TSHRMAPK1KMT2APTPN1
SCHEMBL14593298 0.75 MEN1 (0.46) ARMEN1ALOX15TSHRMAPK1
Water SCHEMBL1684070 0.75 NR1H2 (0.65) ARNR1H2NR1H3MLYCDSMN1; SMN2
SCHEMBL832913 0.73 NR1H3 (0.47) ARMEN1ALOX15TSHRMAPK1
SCHEMBL12128501 0.73 MEN1 (0.64) ARMEN1ALOX15TSHRMAPK1
SCHEMBL309960 0.73 NR1H2 (0.52) ARMEN1ALOX15TSHRMAPK1

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-20040122179-A1 Structures providing low absorbing polymers at 157 nm wavelengths CORNELL RESEARCH FOUNDATION, INC. 2004-06-24 — — US disclosed
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