SCHEMBL3199848

SCHEMBL3199848

Cc1ccccc1OCCn1c(=N)n(Cc2ccc(Br)cc2)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 7/20 0.60
MAPT P10636 3/20 0.54
MAPK1 P28482 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
OPRM1 P35372 1/20 0.54
OPRD1 P41143 1/20 0.54
CXCR3 P49682 1/20 0.49
ALDH1A1 P00352 3/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 2/20 0.46
SLC5A2 P31639 1/20 0.45
TSHR P16473 2/20 0.44
MITF O75030 1/20 0.43

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
SCHEMBL3205881 0.84 TP53 (0.74) TP53MAPTNPSR1CXCR3ALDH1A1
SCHEMBL3193215 0.79 TP53 (0.60) TP53MAPTMAPK1NPSR1OPRM1
SCHEMBL2494637 0.78 TP53 (0.70) TP53MAPTMAPK1NPSR1OPRM1
SCHEMBL2495808 0.77 MAPT (0.61) TP53MAPTMAPK1NPSR1OPRM1
SCHEMBL3207181 0.76 TP53 (0.66) TP53MAPTMAPK1NPSR1OPRM1
SCHEMBL2497655 0.76 LMNA (0.79) MAPTNPSR1CXCR3ALDH1A1TDP1
SCHEMBL2495408 0.75 TP53 (0.67) TP53MAPTMAPK1NPSR1CXCR3
SCHEMBL27976211 0.75 TDP1 (0.63) NPSR1ALDH1A1TDP1POLB
SCHEMBL3194234 0.75 LMNA (0.65) TP53MAPTMAPK1NPSR1OPRM1
SCHEMBL2496126 0.75 CXCR3 (0.77) TP53MAPTNPSR1CXCR3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100035951-A1 2-AMINO BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF SMALL-CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM CHANNELS NEUROSEARCH A/S (DK) 2010-02-11 US disclosed
EP-2041096-A1 2-AMINO BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF SMALL- CONDUCTANCE CALCIUM-ACTIVATED POTATIUM CHANNELS NeuroSearch AS (DK) 2009-04-01 EP disclosed
WO-2008003752-A1 2 -AMINO BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF SMALL - CONDUCTANCE CALCIUM -ACT IVATED POTASSIUM CHANNELS NEUROSEARCH A/S (DK) 2008-01-10 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-20100035951-A1 2-AMINO BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF SMALL-CONDUCTANCE CALCIUM-ACTIVATED POTASSIUM CHANNELS KCNN2, KCNN1, KCNN3 TP53 4533/4885MAPT 2021/4885MAPK1 1923/4885

“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.