SCHEMBL18174709

SCHEMBL18174709

Cc1cccnc1-c1ccc(-c2c3ccccc3c(-c3ccc(-c4cccnc4C)cc3)c3ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.46
MKNK2 Q9HBH9 1/20 0.46
DHODH Q02127 4/20 0.44
CYP2A6 P11509 1/20 0.44
PTGS1 P23219 2/20 0.43
PTGS2 P35354 2/20 0.43
SQOR Q9Y6N5 2/20 0.39
TRPV1 Q8NER1 7/20 0.39
CNR2 P34972 1/20 0.38
GRIA2 P42262 1/20 0.38
MAPT P10636 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL18174567 0.89 CYP2A6 (0.53) DHODHCYP2A6TRPV1CNR2
SCHEMBL16189088 0.89 MKNK1 (0.54) MKNK1MKNK2DHODHCYP2A6PTGS1
SCHEMBL9612955 0.85 DHODH (0.47) MKNK1MKNK2DHODHCYP2A6PTGS1
SCHEMBL9612969 0.82 DHODH (0.47) MKNK1MKNK2DHODHCYP2A6PTGS1
SCHEMBL15161030 0.82 MKNK1 (0.48) MKNK1MKNK2DHODH
SCHEMBL18174649 0.82 CYP2A6 (0.51) DHODHCYP2A6PTGS1PTGS2SQOR
SCHEMBL18174651 0.82 CYP2A6 (0.51) DHODHCYP2A6PTGS2TRPV1CNR2
SCHEMBL18174715 0.81 DHODH (0.51) MKNK1MKNK2DHODHCYP2A6SQOR
SCHEMBL18174688 0.80 CYP17A1 (0.46) MKNK1MKNK2DHODHPTGS2
SCHEMBL18174635 0.80 MKNK1 (0.43) MKNK1MKNK2DHODHCYP2A6PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed
US-9478750-B2 Anthracene derivative and organic electroluminescent element using the same JNC CORPORATION (JP) 2016-10-25 US disclosed