SCHEMBL18174552

SCHEMBL18174552

Cc1cncc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5cncc(C)c5)cc4)c4cc(-c5ccc6ccccc6c5)ccc34)cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 9/20 0.45
CYP11B1 P15538 8/20 0.45
CYP17A1 P05093 2/20 0.44
CYP19A1 P11511 1/20 0.44
PRMT5 O14744 1/20 0.40
WDR77 Q9BQA1 1/20 0.40
CYP1A2 P05177 3/20 0.39
CYP3A4 P08684 3/20 0.39
CYP2C9 P11712 3/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2B6 P20813 1/20 0.39
CYP2C19 P33261 1/20 0.39
CDK7 P50613 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 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
SCHEMBL15977477 0.97 CYP11B1 (0.45) CYP11B2CYP11B1CYP17A1CYP19A1PRMT5
SCHEMBL15977578 0.96 CYP11B2 (0.45) CYP11B2CYP11B1CYP17A1CYP19A1PRMT5
SCHEMBL10032747 0.93 CYP11B1 (0.44) CYP11B2CYP11B1CYP17A1CYP19A1CYP1A2
SCHEMBL10032167 0.91 CYP11B2 (0.50) CYP11B2CYP11B1CYP17A1CYP19A1CYP1A2
SCHEMBL15161111 0.89 CDK7 (0.44) CYP11B2CYP11B1PRMT5WDR77CYP3A4
SCHEMBL15977676 0.89 CDK7 (0.44) CYP11B2CYP11B1PRMT5WDR77CYP3A4
SCHEMBL10032763 0.88 CYP11B2 (0.49) CYP11B2CYP11B1CYP17A1CYP19A1CYP1A2
SCHEMBL10032881 0.88 CYP11B2 (0.49) CYP11B2CYP11B1CYP17A1CYP19A1CYP1A2
SCHEMBL10032719 0.87 CYP11B2 (0.51) CYP11B2CYP11B1CYP17A1CYP19A1CYP1A2
SCHEMBL10300939 0.87 CDK7 (0.44) CYP11B2CYP11B1PRMT5WDR77CYP3A4

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