SCHEMBL3215853

SCHEMBL3215853

Fc1ccc(CN=c2ccn(Cc3ccc(F)c(F)c3)cc2)cc1F

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 5/20 0.42
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
LMNA P02545 3/20 0.41
NPC1 O15118 5/20 0.37
RAB9A P51151 4/20 0.37
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CACNA1G O43497 3/20 0.33
CACNA1H O95180 3/20 0.33
CACNA1I Q9P0X4 3/20 0.33
SOS1 Q07889 1/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
CYP19A1 P11511 1/20 0.32

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
SCHEMBL14207377 0.71 ALDH1A1 (0.40) HTTALDH1A1
SCHEMBL28206073 0.67 CYP11B1 (0.67) CYP11B1CYP11B2CYP19A1
SCHEMBL30932257 0.67 CYP11B1 (0.67) CYP11B1CYP11B2CYP19A1
SCHEMBL3219525 0.66 KCNA3 (0.48) HTTALDH1A1SMN1; SMN2
SCHEMBL3219521 0.66 KCNA3 (0.48) HTTALDH1A1SMN1; SMN2
SCHEMBL3748589 0.66 CACNA1H (0.39) HTTALDH1A1LMNAL3MBTL1CACNA1G
SCHEMBL14457028 0.65 HTT (0.41) HTTALDH1A1CYP11B1CYP11B2DPP4
SCHEMBL3483224 0.65 HTT (0.41) HTTALDH1A1CYP11B1CYP11B2
SCHEMBL21533373 0.61 ALDH1A1 (0.42) HTTALDH1A1CYP11B1CYP11B2CYP19A1
SCHEMBL28857436 0.61 ALDH1A1 (0.42) HTTALDH1A1CYP11B1CYP11B2CYP19A1

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-20100035924-A1 NOVEL 4-AMINO-PYRIDINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-02-11 US claimed
US-20100035924-A1 NOVEL 4-AMINO-PYRIDINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-02-11 US disclosed
US-20100035924-A1 NOVEL 4-AMINO-PYRIDINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-02-11 US disclosed
US-20100035924-A1 NOVEL 4-AMINO-PYRIDINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-02-11 US disclosed
WO-2008058536-A1 NOVEL 4-AMINO-PYRIDINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2008-05-22 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-20100035924-A1 NOVEL 4-AMINO-PYRIDINE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS KCNN1, KCNN2, KCNN3 HTT 2716/4885ALDH1A1 4188/4885SMN1; SMN2 3253/4885

“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.