SCHEMBL2470282

SCHEMBL2470282

CCc1ccc(CCNC(=O)C2(Cc3ccccc3)CCN(C(=O)c3ccc(C)cc3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
RAB9A P51151 2/20 0.48
NPC1 O15118 1/20 0.48
KMT2A Q03164 7/20 0.45
MEN1 O00255 5/20 0.43
PLAAT3 P53816 2/20 0.43
PLAAT5 Q96KN8 2/20 0.43
PLAAT2 Q9NWW9 2/20 0.43
PLAAT4 Q9UL19 2/20 0.43
MAPT P10636 4/20 0.43
TP53 P04637 2/20 0.43
PKM P14618 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
LMNA P02545 2/20 0.42
PKLR P30613 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM3 P20309 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL2471483 0.94 ALDH1A1 (0.55) ALDH1A1RAB9AKMT2AMEN1PKM
SCHEMBL2472974 0.91 KMT2A (0.57) ALDH1A1RAB9ANPC1KMT2AMEN1
SCHEMBL2471026 0.91 EPHX1 (0.50) ALDH1A1KMT2AMEN1PLAAT3PLAAT5
SCHEMBL2465757 0.90 CYP3A4 (0.49) ALDH1A1RAB9AKMT2AMEN1PKLR
SCHEMBL2470146 0.88 ALDH1A1 (0.47) ALDH1A1RAB9ANPC1KMT2AMEN1
SCHEMBL2470362 0.85 CYP2D6 (0.45) ALDH1A1RAB9AKMT2AMEN1LMNA
SCHEMBL2468026 0.85 CHRM2 (0.52) ALDH1A1RAB9ANPC1KMT2AMEN1
SCHEMBL2467860 0.84 KMT2A (0.55) ALDH1A1RAB9ANPC1KMT2AMEN1
SCHEMBL2470205 0.83 ALDH1A1 (0.51) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL2471735 0.83 NPC1 (0.49) ALDH1A1NPC1KMT2AMEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2371366-A1 Heterocyclo inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2011-10-05 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-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

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 ALDH1A1 3941/4885RAB9A 1780/4885NPC1 989/4885

“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.