SCHEMBL7969477

SCHEMBL7969477

Cc1ccc(OC[C@@H](O)CN2CCC(O)(c3cnc4ccccc4c3)CC2)cc1C

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
PRMT5 O14744 1/20 0.48
WDR77 Q9BQA1 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
ABCB1 P08183 7/20 0.46
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
USP2 O75604 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL7966950 0.90 TSHR (0.56) MAPTPRMT5WDR77SMN1; SMN2ABCB1
SCHEMBL7200720 0.90 SMN1; SMN2 (0.57) MAPTPRMT5WDR77SMN1; SMN2ABCB1
SCHEMBL27193282 0.90 SMN1; SMN2 (0.57) MAPTPRMT5WDR77SMN1; SMN2ABCB1
SCHEMBL7953490 0.89 ABCB1 (0.54) MAPTPRMT5WDR77ABCB1
SCHEMBL7953344 0.89 KDM4E (0.53) MAPTPRMT5WDR77SMN1; SMN2ABCB1
SCHEMBL7953454 0.89 PRMT5 (0.47) PRMT5WDR77SMN1; SMN2ABCB1L3MBTL1
SCHEMBL7969553 0.88 L3MBTL1 (0.55) PRMT5WDR77SMN1; SMN2ABCB1KMT2A
SCHEMBL7962982 0.88 SMN1; SMN2 (0.49) MAPTPRMT5WDR77SMN1; SMN2ABCB1
SCHEMBL7966384 0.87 MAPT (0.53) MAPTPRMT5WDR77SMN1; SMN2ABCB1
SCHEMBL7953572 0.87 KMT2A (0.54) MAPTPRMT5WDR77SMN1; SMN2ABCB1

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-6242450-B1 SUBSTITUTED PIPERIDINES ELI LILLY AND COMPANY 2001-06-05 US disclosed
EP-0976746-A1 5-HT1F antagonists ELI LILLY AND COMPANY (US) 2000-02-02 EP disclosed
EP-0976747-A2 Use of 5HT-1F receptor antagonists for treating anxiety disorders ELI LILLY AND COMPANY (US) 2000-02-02 EP disclosed