SCHEMBL1786994

SCHEMBL1786994

O=c1[nH]nc(C2CCCC2)c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.48
WDR77 Q9BQA1 1/20 0.48
ATM Q13315 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ROCK2 O75116 3/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
PARP1 P09874 2/20 0.43
PARP2 Q9UGN5 1/20 0.43
PARP3 Q9Y6F1 1/20 0.43
AR P10275 1/20 0.42
DRD1 P21728 1/20 0.42
DRD5 P21918 1/20 0.42
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 2/20 0.41
ROCK1 Q13464 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL1790181 0.98 PRMT5 (0.47) PRMT5WDR77ATMNPSR1ROCK2
SCHEMBL1786583 0.97 ATM (0.47) PRMT5WDR77ATMNPSR1ROCK2
SCHEMBL1789261 0.93 ATM (0.50) PRMT5ATMNPSR1ROCK2NPC1
SCHEMBL12845934 0.87 ATM (0.45) PRMT5ATMNPSR1ROCK2NPC1
SCHEMBL19902284 0.85 PRMT5 (0.45) PRMT5WDR77ATMNPSR1ROCK2
SCHEMBL19902331 0.85 PRMT5 (0.45) PRMT5WDR77ATMNPSR1ROCK2
SCHEMBL19902592 0.85 ATM (0.44) PRMT5ATMNPSR1ROCK2NPC1
SCHEMBL19902312 0.85 PRMT5 (0.45) PRMT5WDR77ATMNPSR1ROCK2
SCHEMBL12803793 0.84 PARP1 (0.44) ROCK2NPC1RAB9APARP1PARP2
SCHEMBL1933711 0.84 CHRNA7 (0.42) PRMT5WDR77ATMNPSR1ROCK2

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-8629143-B2 Potassium channel modulators ABBVIE INC. (US) 2014-01-14 US disclosed
EP-2504317-A1 POTASSIUM CHANNEL MODULATORS Abbott Laboratories (US) 2012-10-03 EP disclosed
US-20110124642-A1 POTASSIUM CHANNEL MODULATORS ABBOTT LABORATORIES (US) 2011-05-26 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-20110124642-A1 POTASSIUM CHANNEL MODULATORS KCNQ1, KCNQ2, KCNQ3 PRMT5 1154/4885WDR77 2823/4885ATM 3548/4885

“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.