SCHEMBL6565290

SCHEMBL6565290

Nc1nnc(S)n1Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
TSHR P16473 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP19A1 P11511 2/20 0.41
PNP P00491 3/20 0.40
ALDH1A1 P00352 3/20 0.40
CYP3A4 P08684 3/20 0.40
HPGD P15428 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
HTT P42858 2/20 0.39
POLB P06746 1/20 0.39
TNF P01375 1/20 0.38
CXCL8 P10145 1/20 0.38
SOS1 Q07889 1/20 0.38
NOD2 Q9HC29 1/20 0.38
NOD1 Q9Y239 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL5175302 0.86 KDM4E (0.50) KDM4ETSHRNPSR1CYP19A1PNP
SCHEMBL14160787 0.81 KDM4E (0.50) KDM4ETSHRNPSR1CYP19A1ALDH1A1
SCHEMBL7805983 0.78 KDM4E (0.43) KDM4ETSHRNPSR1CYP19A1ALDH1A1
SCHEMBL10480363 0.78 KDM4E (0.51) KDM4ETSHRNPSR1CYP19A1ALDH1A1
SCHEMBL10012854 0.76 SMN1; SMN2 (0.52) KDM4ETSHRNPSR1CYP19A1ALDH1A1
SCHEMBL1104400 0.76 ALDH1A1 (0.50) KDM4ETSHRNPSR1ALDH1A1HPGD
SCHEMBL10480359 0.76 ALDH1A1 (0.51) KDM4ETSHRNPSR1CYP19A1ALDH1A1
SCHEMBL5012601 0.75 SMN1; SMN2 (0.41) KDM4ETSHRNPSR1CYP19A1ALDH1A1
SCHEMBL15801095 0.75 KDM4E (0.45) KDM4ETSHRNPSR1CYP19A1ALDH1A1
SCHEMBL11380650 0.75 SMN1; SMN2 (0.41) KDM4ETSHRNPSR1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0809144-B1 Substantially non-photosensitive thermographic recording material with improved stability and image-tone AGFA GEVAERT (BE) 2004-04-07 EP disclosed
US-5854174-A Substantially non-photosensitive thermographic recording material with improved stability and image-tone AGFA-GEVAERT (BE) 1998-12-29 US disclosed
US-5750319-A LIGHT-INSENSITIVE ORGANIC SILVER SALT, ORGANIC REDUCING AGENT, 1,2,4-TRIAZOLE COMPOUND AGFA-GEVAERT (BE) 1998-05-12 US disclosed
EP-0809144-A1 Substantially non-photosensitive thermographic recording material with improved stability and image-tone AGFA-GEVAERT N.V. (BE) 1997-11-26 EP disclosed
EP-0809143-A1 Substantially non-photosensitive thermographic recording material with improved stability and image-tone AGFA-GEVAERT N.V. (BE) 1997-11-26 EP disclosed