SCHEMBL6337668

SCHEMBL6337668

CC(C)(C)c1ccc(OP(=O)(Cl)Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
MAPT P10636 4/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPK1 P28482 2/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 3/20 0.43
POLB P06746 2/20 0.43
HTT P42858 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALOX15 P16050 1/20 0.40
APEX1 P27695 1/20 0.40
RECQL P46063 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL6300591 0.88 TSHR (0.41) MAPTALDH1A1HPGDLMNAPOLB
SCHEMBL11790553 0.88 CA1 (0.46) CA1CA2CA9MAPTNPC1
SCHEMBL9949539 0.84 MAPT (0.46) CA1CA2CA9MAPTNPC1
SCHEMBL190945 0.83 TSHR (0.58) CA1CA2CA9MAPTNPC1
SCHEMBL10015246 0.82 MEN1 (0.48) CA1CA2HPGDSMN1; SMN2TDP1
SCHEMBL11508054 0.81 MEN1 (0.46) NPC1RAB9AALDH1A1LMNAPOLB
SCHEMBL5191765 0.81 CYP3A4 (0.51) MAPTALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL10784381 0.81 LMNA (0.48) CA1CA2CA9MAPTNPC1
SCHEMBL4624141 0.81 TSHR (0.56) CA1CA2CA9MAPTNPC1
SCHEMBL11806179 0.79 MAPT (0.44) CA1CA2CA9MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3965220-A AMINE CATALYST MONSANTO COMPANY (US) 1976-06-22 US claimed
US-20050009775-A1 Nucleoside compounds in hcv GLAXO GROUP LIMITED (GB) 2005-01-13 US disclosed
EP-1404694-A1 NUCLEOSIDE COMPOUNDS IN HCV GLAXO GROUP LIMITED (GB) 2004-04-07 EP disclosed
WO-2003000713-A1 NUCLEOSIDE COMPOUNDS IN HCV GLAXO GROUP LIMITED (GB) 2003-01-03 WO disclosed
US-4144394-A FLAME RETARDANTS FOR POLYMERS MONSANTO COMPANY (US) 1979-03-13 US disclosed
US-4134877-A Flame retardant phosphoramidate compositions MONSANTO COMPANY (US) 1979-01-16 US disclosed
US-4124400-A Flame retardant polymer compositions MONSANTO COMPANY (US) 1978-11-07 US disclosed
US-4086302-A FLAME RETARDANTS MONSANTO COMPANY (US) 1978-04-25 US disclosed
US-4062909-A FIRE RETARDANTS MONSANTO COMPANY (US) 1977-12-13 US disclosed
US-3965220-A AMINE CATALYST MONSANTO COMPANY (US) 1976-06-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050009775-A1 Nucleoside compounds in hcv OR10J3, NR1H3, ORC3 CA1 4463/4885CA2 4827/4885CA9 2808/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.