SCHEMBL106060

SCHEMBL106060

CC=Cc1cc(C(=O)Oc2c(F)c(F)c(F)c(F)c2F)ccc1N1CCN(C(=O)O)CC1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 9/20 0.37
ALDH1A1 P00352 8/20 0.37
LMNA P02545 4/20 0.37
HPGD P15428 4/20 0.37
NPC1 O15118 3/20 0.37
TSHR P16473 2/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
KMT2A Q03164 5/20 0.36
MEN1 O00255 3/20 0.36
HTT P42858 1/20 0.36
WDR5 P61964 1/20 0.35
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL106059 1.00 L3MBTL1 (0.37) L3MBTL1MAPTALDH1A1LMNAHPGD
SCHEMBL3593527 0.86 HPGD (0.34) MAPTALDH1A1LMNAHPGDKMT2A
SCHEMBL3593526 0.86 HPGD (0.34) MAPTALDH1A1LMNAHPGDKMT2A
SCHEMBL3593522 0.86 HPGD (0.34) MAPTALDH1A1LMNAHPGDKMT2A
SCHEMBL3596344 0.85 ALDH1A1 (0.49) MAPTALDH1A1HPGDNPC1TSHR
SCHEMBL3596349 0.85 ALDH1A1 (0.49) MAPTALDH1A1HPGDNPC1TSHR
SCHEMBL104415 0.84 MEN1 (0.43) L3MBTL1MAPTALDH1A1LMNAKMT2A
SCHEMBL103483 0.79 MEN1 (0.42) MAPTLMNAKMT2AMEN1
SCHEMBL103213 0.79 PRMT1 (0.38) MAPT
SCHEMBL103214 0.79 PRMT1 (0.38) MAPT

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-2426113-B1 CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER KOWA CO (JP) 2013-11-06 EP disclosed
US-8551985-B2 Carbinol derivatives having heterocyclic linker KOWA COMPANY, LTD. (JP) 2013-10-08 US disclosed
EP-2426113-A1 CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER Kowa Company, Ltd. (JP) 2012-03-07 EP disclosed
US-20100280013-A1 CARBINOL DERIVATIVES HAVING HETEROCYCLIC LINKER KOWA COMPANY, LTD. (JP) 2010-11-04 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-20100280013-A1 CARBINOL DERIVATIVES HAVING HETEROCYCLIC LINKER NR1H2, NR1H3, CCR2 L3MBTL1 1132/4885MAPT 2589/4885ALDH1A1 4311/4885

“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.