SCHEMBL8283980

SCHEMBL8283980

CN(Cc1ccccc1)C[C@H]1CC[C@H](C)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
BLM P54132 1/20 0.46
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
PRMT8 Q9NR22 1/20 0.44
TSHR P16473 2/20 0.44
USP2 O75604 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
PYCR1 P32322 1/20 0.43
ACHE P22303 2/20 0.42
AOC3 Q16853 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
KDM4E B2RXH2 1/20 0.41
SLC18A3 Q16572 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40

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
SCHEMBL14045705 0.93 ALDH1A1 (0.52) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL4686478 0.85 CARM1 (0.47) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL522763 0.84 SLC18A3 (0.49) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL7768827 0.83 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL1191857 0.81 HTT (0.54) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL5651526 0.81 GBA1 (0.56) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL12685123 0.80 ALDH1A1 (0.41) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL16327151 0.77 PYCR1 (0.50) PYCR1
SCHEMBL8015547 0.76 SLC6A2 (0.42) ALDH1A1LMNASMN1; SMN2BLMCARM1
SCHEMBL31716232 0.76 CARM1 (0.49) ALDH1A1LMNASMN1; SMN2BLMCARM1

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
EP-1727812-B1 NOVEL CYCLOALKYL-CONTAINING 5-ACYLINDOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PRODUCTS BOEHRINGER INGELHEIM INT (DE) 2008-12-31 EP disclosed
US-7262206-B2 Cycloalkyl—containing 5-acylindolinones, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-28 US disclosed
WO-2005087761-A1 NOVEL CYCLOALKYL-CONTAINING 5-ACYLINDOLINONES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PRODUCTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-09-22 WO disclosed