SCHEMBL11049508

SCHEMBL11049508

COc1ccc(Cc2c[nH]cn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.47
ALDH1A1 P00352 5/20 0.46
LMNA P02545 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
POLB P06746 1/20 0.43
CYP2D6 P10635 1/20 0.42
ATM Q13315 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MPI P34949 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
IDO1 P14902 1/20 0.41
SLC6A4 P31645 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL2104239 0.91 PTGIR (0.51) LTA4HALDH1A1LMNASMN1; SMN2POLB
SCHEMBL6965891 0.82 ALDH1A1 (0.42) ALDH1A1LMNASMN1; SMN2POLBATM
SCHEMBL6965898 0.82 GRIN2B (0.55)
SCHEMBL2103486 0.81 FGFR1 (0.50) LTA4HPOLBIDO1
SCHEMBL6972732 0.80 NOTUM (0.39) LTA4HALDH1A1POLBIDO1
SCHEMBL11050091 0.80 LPL (0.36) ALDH1A1LMNASMN1; SMN2CYP2D6HPGD
SCHEMBL7971472 0.78 HRH3 (0.48) ALDH1A1LMNASMN1; SMN2ATM
SCHEMBL7988592 0.77 TDP1 (0.45) ALDH1A1LMNASMN1; SMN2POLBCYP2D6
SCHEMBL7987297 0.77 HRH3 (0.54) ALDH1A1LMNASMN1; SMN2ATMHPGD
SCHEMBL6971279 0.77 HRH3 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US claimed
EP-0024829-B1 4-BENZYL- AND 4-BENZOYLIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME Farmos-Yhtyma Oy (FI) 1984-04-25 EP disclosed
US-4443466-A DIURETICS, SEDATIVES, ANALGESICS Farmos-Yhtyma OY (Farmos Group Ltd.) (FI) 1984-04-17 US disclosed
EP-0024829-A1 4-Benzyl- and 4-benzoylimidazole derivatives, processes for their preparation and pharmaceutical compositions comprising the same Farmos-Yhtyma Oy (FI) 1981-03-11 EP disclosed