SCHEMBL1996015

SCHEMBL1996015

Fc1ccc(Nc2nc3ccccc3[nH]2)c(F)c1F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.57
NPC1 O15118 9/20 0.54
RAB9A P51151 8/20 0.54
LMNA P02545 4/20 0.54
TP53 P04637 4/20 0.54
MAPT P10636 3/20 0.54
NPSR1 Q6W5P4 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.50
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
ALOX15 P16050 2/20 0.50
ALDH1A1 P00352 2/20 0.50
POLB P06746 2/20 0.50
CYP1A2 P05177 1/20 0.50
HPGD P15428 1/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
PKM P14618 2/20 0.48

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
SCHEMBL3612086 0.83 GAA (0.67) GAANPC1RAB9ALMNATP53
SCHEMBL28050241 0.78 RAB9A (0.68) GAANPC1RAB9ALMNATP53
SCHEMBL2000202 0.77 GAA (0.56) GAANPC1RAB9ALMNATP53
SCHEMBL28728369 0.76 RAB9A (0.66) GAANPC1RAB9ALMNATP53
SCHEMBL1999412 0.76 MEN1 (0.61) GAANPC1RAB9ALMNATP53
SCHEMBL3610711 0.75 GAA (0.56) GAANPC1RAB9ALMNATP53
SCHEMBL824423 0.73 RAB9A (0.75) GAANPC1RAB9ALMNATP53
SCHEMBL9081342 0.73 GAA (1.00) GAANPC1RAB9ALMNATP53
SCHEMBL5695259 0.73 GAA (0.67) GAANPC1RAB9ALMNATP53
SCHEMBL5695253 0.73 GAA (0.67) GAANPC1RAB9ALMNATP53

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-20090076106-A1 2-(Phenylamino) Benzimidazole Derivatives and Their Use as Modulators of Small- Conductance Calcuim-Activated Potassium Channels NEUROSEARCH A/S (DK) 2009-03-19 US claimed
US-7960561-B2 2-(phenylamino) benzimidazole derivatives and their use as modulators of small-conductance calcium-activated potassium channels NEUROSEARCH A/S (DK) 2011-06-14 US disclosed
US-20090076106-A1 2-(Phenylamino) Benzimidazole Derivatives and Their Use as Modulators of Small- Conductance Calcuim-Activated Potassium Channels NEUROSEARCH A/S (DK) 2009-03-19 US disclosed
EP-1896427-A2 NOVEL 2-(PHENYLAMINO)BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF SMALL-CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM CHANNELS NeuroSearch A/S (DK) 2008-03-12 EP disclosed
WO-2006136580-A2 2-(PHENYLAMINO)BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF SMALL-CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM CHANNELS NEUROSEARCH A/S (DK) 2006-12-28 WO 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-20090076106-A1 2-(Phenylamino) Benzimidazole Derivatives and Their Use as Modulators of Small- Conductance Calcuim-Activated Potassium Channels KCNN2, KCNN1, KCNN3 GAA 2861/4885NPC1 1565/4885RAB9A 2556/4885

“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.