SCHEMBL4940571

SCHEMBL4940571

Cc1ccc(NCc2ccc(F)cc2)cc1NC(=O)CC(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.54
KCNQ3 O43525 2/20 0.49
KCNQ2 O43526 2/20 0.49
KCNQ4 P56696 1/20 0.49
KCNQ5 Q9NR82 1/20 0.49
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
KMT2A Q03164 3/20 0.44
P4HTM Q9NXG6 1/20 0.44
PPARA Q07869 3/20 0.44
STING1 Q86WV6 1/20 0.44
MEN1 O00255 2/20 0.43
MAPT P10636 1/20 0.43
KCNJ6 P48051 1/20 0.42
KCNJ5 P48544 1/20 0.42
KCNJ3 P48549 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL4946103 0.82 HPGD (0.56) HPGDKCNQ3KCNQ2KCNQ4KCNQ5
SCHEMBL4939480 0.81 HPGD (0.52) HPGDKCNQ3KCNQ2ALDH1A1LMNA
SCHEMBL4938496 0.79 HPGD (0.58) HPGDKCNQ3KCNQ2KCNQ4KCNQ5
SCHEMBL4938487 0.79 HPGD (0.54) HPGDKCNQ3KCNQ2KCNQ4KCNQ5
SCHEMBL4944587 0.78 HPGD (0.57) HPGDKCNQ3KCNQ2ALDH1A1LMNA
SCHEMBL19700160 0.78 KCNQ3 (0.61) HPGDKCNQ3KCNQ2KCNQ4KCNQ5
SCHEMBL19690597 0.77 HPGD (0.52) HPGDKCNQ3KCNQ2KCNQ4KCNQ5
SCHEMBL4943406 0.77 HPGD (0.52) HPGDKCNQ3KCNQ2KCNQ4KCNQ5
SCHEMBL4946187 0.76 HPGD (0.51) HPGDKCNQ3KCNQ2KCNQ4KCNQ5
SCHEMBL22299355 0.76 KCNQ3 (0.62) HPGDKCNQ3KCNQ2KCNQ4KCNQ5

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
US-20080045534-A1 Derivatives of 1,3-diamino benzene as potassium channel modulators VALEANT PHARMACEUTICALS NORTH AMERICA (US) 2008-02-21 US claimed
US-20080045534-A1 Derivatives of 1,3-diamino benzene as potassium channel modulators VALEANT PHARMACEUTICALS NORTH AMERICA (US) 2008-02-21 US disclosed
US-20080045534-A1 Derivatives of 1,3-diamino benzene as potassium channel modulators VALEANT PHARMACEUTICALS NORTH AMERICA (US) 2008-02-21 US disclosed
US-20080045534-A1 Derivatives of 1,3-diamino benzene as potassium channel modulators VALEANT PHARMACEUTICALS NORTH AMERICA (US) 2008-02-21 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-20080045534-A1 Derivatives of 1,3-diamino benzene as potassium channel modulators KCNQ1, KCNQ2, KCNA1 HPGD 2327/4885KCNQ3 8/4885KCNQ2 2/4885

“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.