SCHEMBL6698052

SCHEMBL6698052

Clc1ccccc1CNc1cccc(NCc2ccccc2Cl)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
ATM Q13315 1/20 0.53
PLA2G1B P04054 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 0.53
ATG4B Q9Y4P1 1/20 0.53
RAB9A P51151 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
GFER P55789 1/20 0.53
NPC1 O15118 3/20 0.52
MAOB P27338 1/20 0.50
FFAR1 O14842 1/20 0.50
TP53 P04637 2/20 0.49
THRB P10828 2/20 0.49

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
SCHEMBL632689 0.91 KCNJ5 (0.60) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL7988500 0.88 RAB9A (0.65) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL6692716 0.87 KCNJ5 (0.50) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL6690806 0.85 RAB9A (0.67) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL6694596 0.84 TP53 (0.54) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL6691733 0.82 MAPT (0.55) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL11225084 0.81 KCNJ5 (0.51) MAPTRAB9ASMN1; SMN2GFERNPC1
SCHEMBL6495858 0.80 MAPT (0.50) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL11511314 0.80 MEN1 (0.68) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL6693381 0.79 P2RX1 (0.55) MAPTL3MBTL1CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040009973-A1 Phenylenediamine derivatives N-substituted with benzyl- or heteroarylmethyl- groups 4SC AG (DE) 2004-01-15 US disclosed
WO-2003076388-A2 BIS-ANILINE DERIVATIVES USEFUL AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2003-09-18 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-20040009973-A1 Phenylenediamine derivatives N-substituted with benzyl- or heteroarylmethyl- groups PAH, PNMT, OPRM1 MAPT 3951/4885L3MBTL1 2590/4885CYP1A2 15/4885

“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.