SCHEMBL2471547

SCHEMBL2471547

Cn1c(C2(c3ccccc3)CCN(C(=O)COc3ccccc3)CC2)nc2cc(F)ccc21

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 1/20 0.55
ADORA2B P29275 3/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ADORA2A P29274 2/20 0.46
ADORA1 P30542 1/20 0.46
OPRD1 P41143 4/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
OPRK1 P41145 1/20 0.45
POLB P06746 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
KDM4E B2RXH2 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
SCHEMBL2465408 0.97 CPT1A (0.52) CPT1AADORA2BALDH1A1LMNASMN1; SMN2
SCHEMBL2468700 0.85 EPHX2 (0.48) ALDH1A1SMN1; SMN2OPRD1MEN1KMT2A
SCHEMBL2469399 0.75 SMN1; SMN2 (0.52) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL13593972 0.73 OPRD1 (0.37) ALDH1A1SMN1; SMN2OPRD1OPRK1
SCHEMBL13593964 0.73 PKM (0.37) ALDH1A1LMNASMN1; SMN2OPRD1MEN1
SCHEMBL13593968 0.72 OPRD1 (0.36) ALDH1A1LMNAOPRD1OPRK1
SCHEMBL13593966 0.71 OPRD1 (0.35) OPRD1OPRK1
SCHEMBL6030899 0.68 MEN1 (0.64) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL2702559 0.68 KMT2A (0.68) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL10721826 0.67 MEN1 (1.00) ALDH1A1LMNASMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2228065-B1 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB CO (US) 2012-12-26 EP disclosed
EP-1501467-B1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL MYERS SQUIBB CO (US) 2012-05-09 EP disclosed
EP-2371366-A1 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2011-10-05 EP disclosed
EP-2228065-A2 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-09-15 EP disclosed
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2009-12-17 US disclosed
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2009-12-17 US disclosed
US-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2009-12-17 US disclosed
US-7582654-B2 Heterocyclo inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2009-09-01 US disclosed
US-7582654-B2 Heterocyclo inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2009-09-01 US disclosed
US-7005436-B2 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB COMPANY (US) 2006-02-28 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-20090312307-A1 HETEROCYCLO INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNH2, KCNQ5 CPT1A 2659/4885ADORA2B 4256/4885ALDH1A1 3941/4885

“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.