SCHEMBL2867648

SCHEMBL2867648

O=C(NCc1ccc(Cl)c(Cl)c1)C1(c2ccccc2)CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERCC1 P07992 1/20 0.71
ERCC4 Q92889 1/20 0.71
TSHR P16473 3/20 0.56
LMNA P02545 2/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
HTT P42858 1/20 0.56
NPSR1 Q6W5P4 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
HDAC4 P56524 2/20 0.54
ALDH1A1 P00352 3/20 0.51
TRPV1 Q8NER1 1/20 0.50
TACR1 P25103 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CHRM2 P08172 1/20 0.48
CHRM1 P11229 1/20 0.48
FTO Q9C0B1 1/20 0.48
SSTR3 P32745 1/20 0.46
AKR1C1 Q04828 1/20 0.45

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
SCHEMBL2861779 0.85 ERCC1 (0.68) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL5346968 0.85 ERCC1 (0.75) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL2857072 0.82 ERCC1 (0.71) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL14491527 0.82 ERCC1 (0.71) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL2858745 0.82 ERCC1 (0.60) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL2857030 0.81 ERCC1 (0.70) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL2861090 0.80 ERCC1 (0.68) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL2861856 0.80 ERCC1 (0.68) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL20210692 0.80 ERCC1 (0.68) ERCC1ERCC4TSHRLMNASMN1; SMN2
SCHEMBL14613479 0.80 ERCC1 (0.67) ERCC1ERCC4TSHRLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2253328-A1 Cycloalkyl inhibitors of potassium channel function Bristol-Myers Squibb Company (US) 2010-11-24 EP disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION BRISTOL-MYERS SQUIBB COMPANY 2007-06-21 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-7202253-B2 Cycloalkyl inhibitors of potassium channel function BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-10 US disclosed
US-20050234106-A1 Cycloalkyl inhibitors of potassium channel function LLOYD JOHN 2005-10-20 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 (2 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-20050234106-A1 Cycloalkyl inhibitors of potassium channel function KCNJ2, KCNN3, KCNQ5 ERCC1 3164/4885ERCC4 3218/4885TSHR 2501/4885
US-20070142333-A1 CYCLOALKYL INHIBITORS OF POTASSIUM CHANNEL FUNCTION KCNJ2, KCNN3, KCNQ5 ERCC1 3164/4885ERCC4 3218/4885TSHR 2501/4885

“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.