SCHEMBL9602749

SCHEMBL9602749

CC1C=Cc2nc3ccccc3nc2C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 2/20 0.35
ACHE P22303 2/20 0.35
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL24115655 0.76 HKDC1 (0.32)
SCHEMBL28524861 0.70
SCHEMBL24850398 0.69
SCHEMBL38102 0.68 MAPT (0.39) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL14572406 0.67 MAPT (0.42) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL7168251 0.67 MAPT (0.37) KDM4EALDH1A1MAPTMAPK1TSHR
SCHEMBL13892116 0.67 MAPT (0.37) KDM4EALDH1A1MAPTMAPK1SMN1; SMN2
SCHEMBL7168253 0.67 MAPT (0.37) KDM4EALDH1A1MAPTMAPK1TSHR
SCHEMBL21318171 0.67 GRM5 (0.33) ALDH1A1
SCHEMBL19339183 0.66

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-0250676-B1 NON-ENZYMATIC IMMUNOHISTOCHEMICAL STAINING SYSTEM AND REAGENTS Immunomedics, Inc. (US) 1993-03-10 EP disclosed
US-4792521-A Non-enzymatic immunohistochemical staining system and reagents IMMUNOMEDICS, INC. (US) 1988-12-20 US disclosed
EP-0250676-A2 Non-enzymatic immunohistochemical staining system and reagents Immunomedics, Inc. (US) 1988-01-07 EP disclosed