SCHEMBL7316402

SCHEMBL7316402

C[C@H](N)C(=O)NC(c1ccccc1)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 5/20 0.63
LMNA P02545 2/20 0.54
TAAR1 Q96RJ0 1/20 0.50
TSHR P16473 1/20 0.50
XIAP P98170 4/20 0.49
HPGDS O60760 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PRCP P42785 1/20 0.46
CTSD P07339 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL7318689 0.85 LMNA (0.51) CTRB1LMNATSHRHPGDSMEN1
SCHEMBL7311069 0.85 LMNA (0.51) CTRB1LMNATSHRHPGDSMEN1
SCHEMBL12310933 0.85 MEN1 (0.64) CTRB1LMNAMEN1KMT2APRCP
SCHEMBL28260728 0.85 MEN1 (0.64) CTRB1LMNAMEN1KMT2APRCP
SCHEMBL12640063 0.85 MEN1 (0.64) CTRB1LMNAMEN1KMT2APRCP
SCHEMBL12757448 0.84 LMNA (0.53) LMNATSHRHPGDSMEN1KMT2A
SCHEMBL7371275 0.82 SLC6A9 (0.53) CTRB1TSHRKMT2A
SCHEMBL3175279 0.81 CTRB1 (0.59) CTRB1LMNATAAR1MEN1KMT2A
SCHEMBL891425 0.81 CTRB1 (0.59) CTRB1LMNATAAR1XIAPMEN1
SCHEMBL31656407 0.81 CTRB1 (0.59) CTRB1LMNATAAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1041064-A2 N-substituted alpha aminoacid amides as calcium channel modulators ELI LILLY AND COMPANY LIMITED (GB) 2000-10-04 EP disclosed
EP-0805147-A1 Novel N-substituted alpha aminoacid amides as calcium channel modulators LILLY INDUSTRIES LIMITED (GB) 1997-11-05 EP disclosed