SCHEMBL23440102

SCHEMBL23440102

O=c1c(=O)n(Cc2ccc(Cl)cc2)ccn1CCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.59
THRB P10828 2/20 0.59
POLB P06746 4/20 0.58
TP53 P04637 3/20 0.58
LMNA P02545 3/20 0.55
HTT P42858 1/20 0.55
CAPN1 P07384 1/20 0.53
VEGFA P15692 2/20 0.53
EGLN1 Q9GZT9 2/20 0.53
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PSMB2 P49721 1/20 0.45
NPSR1 Q6W5P4 2/20 0.45
SIGMAR1 Q99720 1/20 0.45
MAPK14 Q16539 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL31352365 0.74 HSP90AB1 (0.52) MAPTLMNAHTTCAPN1ALDH1A1
SCHEMBL4480893 0.74 MAPK14 (0.69) MAPTCAPN1ALDH1A1KDM4EPSMB2
SCHEMBL8196751 0.71 SIGMAR1 (0.58) LMNAALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL20266274 0.70 SIGMAR1 (0.50) POLBALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL27478800 0.69 F2 (0.54) MAPTTP53LMNAHTTALDH1A1
SCHEMBL4591947 0.69 POLB (0.61) MAPTTHRBPOLBTP53LMNA
SCHEMBL29001250 0.69 LMNA (0.58) MAPTTHRBPOLBLMNAHTT
Ammonia Solution, Strong SCHEMBL11188168 0.69 SIGMAR1 (0.56) LMNAALDH1A1MEN1KMT2ASIGMAR1
SCHEMBL1770401 0.69 EGLN1 (1.00) MAPTTHRBPOLBTP53LMNA
SCHEMBL6524399 0.69 VEGFA (0.65) MAPTTHRBTP53LMNAHTT

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-4403042-A2 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME Mars, Incorporated (US) 2024-07-24 EP disclosed
EP-3229612-B1 USE OF FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS INC (US) 2024-06-26 EP disclosed
EP-3229610-B1 FLAVOR COMPOSITIONS AND PET FOOD PRODUCTS CONTAINING THE SAME MARS INC (US) 2021-06-09 EP disclosed