SCHEMBL5373777

SCHEMBL5373777

NCCOB(Oc1cccc(C(F)(F)F)c1)Oc1cccc(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.45
MAOB P27338 4/20 0.45
AOC3 Q16853 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PNMT P11086 1/20 0.42
IDO1 P14902 2/20 0.41
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
KIF11 P52732 1/20 0.39
LTA4H P09960 1/20 0.39

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
SCHEMBL1555852 0.84 IDO1 (0.38) TAAR1MAOBAOC3KDM4EIDO1
SCHEMBL31612146 0.82 MGLL (0.47) MAOBAOC3L3MBTL1KDM4EIDO1
SCHEMBL1483908 0.82 MGLL (0.47) MAOBAOC3L3MBTL1KDM4EIDO1
SCHEMBL1555109 0.81 MAOB (0.43) TAAR1MAOBAOC3IDO1
SCHEMBL3524104 0.79 L3MBTL1 (0.59) TAAR1MAOBAOC3L3MBTL1KDM4E
SCHEMBL5377022 0.76 ACHE (0.44) TAAR1L3MBTL1KDM4ELMNATSHR
SCHEMBL5372565 0.76 WDR5 (0.41) TAAR1MAOBAOC3KDM4EPNMT
SCHEMBL465983 0.75 TAAR1 (0.54) TAAR1KDM4ETSHRMAPK1KIF11
SCHEMBL10692820 0.74 L3MBTL1 (0.57) TAAR1MAOBAOC3L3MBTL1KDM4E
SCHEMBL1555313 0.74 IDO1 (0.43) L3MBTL1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040259842-A1 Intracellular calcuim concentration increase inhibitors MIKOSHIBA, KATSUHIKO (JP) 2004-12-23 US claimed
EP-1444981-A1 INTRACELLULAR CALCIUM CONCENTRATION INCREASE INHIBITORS Mikoshiba, Katsuhiko (JP) 2004-08-11 EP claimed
US-7217701-B2 Intracellular calcium concentration increase inhibitors KATSUHIKO MIKOSHIBA (JP) 2007-05-15 US disclosed
US-20040259842-A1 Intracellular calcuim concentration increase inhibitors MIKOSHIBA, KATSUHIKO (JP) 2004-12-23 US disclosed
EP-1444981-A1 INTRACELLULAR CALCIUM CONCENTRATION INCREASE INHIBITORS Mikoshiba, Katsuhiko (JP) 2004-08-11 EP 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-20040259842-A1 Intracellular calcuim concentration increase inhibitors CAB39, BPGM, ORAI1 TAAR1 2077/4885MAOB 2523/4885AOC3 2603/4885

“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.