SCHEMBL27775729

SCHEMBL27775729

CCON(CCNCCN)Cc1ccccc1.[Gd]

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
PRMT8 Q9NR22 1/20 0.41
REN P00797 2/20 0.41
SIGMAR1 Q99720 2/20 0.40
KCNH2 Q12809 2/20 0.37
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
BACE1 P56817 1/20 0.36
ALDH1A1 P00352 1/20 0.35
AOC3 Q16853 1/20 0.35

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
SCHEMBL29700371 0.99 CARM1 (0.42) CARM1PRMT6PRMT8RENSIGMAR1
Acetic Acid SCHEMBL4347586 0.95 REN (0.47) CARM1PRMT6PRMT8RENSIGMAR1
Acetic Acid SCHEMBL27681175 0.93 REN (0.48) CARM1PRMT6PRMT8RENSIGMAR1
Acetic Acid SCHEMBL4347583 0.90 REN (0.45) CARM1PRMT6PRMT8RENSIGMAR1
SCHEMBL1703434 0.81 CARM1 (0.45) CARM1PRMT6PRMT8SIGMAR1
SCHEMBL8423289 0.76 TSHR (0.50) CARM1PRMT6PRMT8CYP2C19ALDH1A1
Acetic Acid SCHEMBL27464542 0.76 REN (0.41) CARM1PRMT6PRMT8RENSIGMAR1
Hydrochloric Acid SCHEMBL9008780 0.75 MAPT (0.51) CARM1PRMT6PRMT8SIGMAR1KCNH2
SCHEMBL11293490 0.75 CARM1 (0.47) CARM1PRMT6PRMT8RENKCNH2
SCHEMBL21121016 0.73 CARM1 (0.46) CARM1PRMT6PRMT8RENKCNH2

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
CN-101528124-A Method for imaging the lymphatic system EPIX PHARM INC (US) 2009-09-09 CN disclosed