SCHEMBL6699747

SCHEMBL6699747

CCC(O)n1nc2ccccc2n1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
ATM Q13315 1/20 0.37
TSHR P16473 3/20 0.36
KDM4E B2RXH2 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HPGD P15428 1/20 0.35
MPO P05164 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RECQL P46063 1/20 0.35
HTT P42858 1/20 0.34
SLC9A1 P19634 1/20 0.33
TRPA1 O75762 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL11406067 0.77 KDM4E (0.41) LMNAATMTSHRKDM4ENPSR1
SCHEMBL19731267 0.76 TDP1 (0.40) LMNATSHRKDM4EHPGDMPO
SCHEMBL6962063 0.75 KDM4E (0.47) KDM4ENPSR1HPGDSMN1; SMN2RECQL
SCHEMBL1311977 0.73 LMNA (0.40) LMNATSHRKDM4EHPGDSMN1; SMN2
SCHEMBL20872965 0.72 CSNK2A1 (0.53) LMNAATMTSHRKDM4ENPSR1
SCHEMBL28366460 0.72 ATM (0.36) LMNAATMKDM4ENPSR1MPO
SCHEMBL5846689 0.72 TAAR1 (0.39) LMNAKDM4ENPC1RAB9AALDH1A1
SCHEMBL9344956 0.71 ATM (0.37) LMNAATMKDM4EHPGDMPO
SCHEMBL6229399 0.70 HTT (0.45) LMNAATMTSHRKDM4ENPSR1
SCHEMBL1083857 0.70 MPO (0.42) LMNAATMTSHRKDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040014863-A1 Uv-resistant hot-melt contact adhesive, a method for producing the same and adhesive objects produced therefrom HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2004-01-22 US disclosed