SCHEMBL12247017

SCHEMBL12247017

CC1(C)c2cc(-c3ccc(-c4ccccn4)nc3)ccc2-c2cc3c(-c4cccc5ccccc45)c4ccccc4c(-c4cccc5ccccc45)c3cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.38
KDM4E B2RXH2 2/20 0.37
TP53 P04637 2/20 0.37
MAPK1 P28482 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PDK2 Q15119 1/20 0.35
TGFBR1 P36897 2/20 0.35
DCTPP1 Q9H773 1/20 0.33
HPGDS O60760 2/20 0.32
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
CYP2C9 P11712 1/20 0.32
CCR1 P32246 2/20 0.31
CCR5 P51681 2/20 0.31
CCR8 P51685 2/20 0.31

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
SCHEMBL12247266 0.93 HTR2C (0.39) HTR2CKDM4ETP53MAPK1SMN1; SMN2
SCHEMBL13459686 0.93 HTR2C (0.39) HTR2CKDM4ETP53MAPK1SMN1; SMN2
SCHEMBL12247029 0.91 PDK2 (0.35) PDK2HPGDSGABRA1GABRG2GABRB3
SCHEMBL12247026 0.90 PDK2 (0.33) KDM4ESMN1; SMN2NPC1ALDH1A1HPGD
SCHEMBL12247018 0.89 HPGDS (0.37) MAPK1HSD17B10PDK2TGFBR1HPGDS
SCHEMBL12247027 0.89 PDK2 (0.40) HTR2CKDM4ETP53SMN1; SMN2NPC1
SCHEMBL12247010 0.88 KDM4E (0.37) KDM4ETP53SMN1; SMN2NPC1ALDH1A1
SCHEMBL12247011 0.87 HPGDS (0.39) KDM4ETP53MAPK1SMN1; SMN2NPC1
SCHEMBL12247022 0.87 HPGDS (0.37) KDM4ETP53MAPK1SMN1; SMN2ALDH1A1
SCHEMBL12247016 0.86 HPGDS (0.39) KDM4ETP53MAPK1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8525158-B2 Anthracene derivative and organic electroluminescence element using the same DOOSAN CORPORATION (KR) 2013-09-03 US disclosed
US-8525158-B2 Anthracene derivative and organic electroluminescence element using the same DOOSAN CORPORATION (KR) 2013-09-03 US disclosed
US-20110210320-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME DOOSAN CORPORATION (KR) 2011-09-01 US disclosed
US-20110210320-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME DOOSAN CORPORATION (KR) 2011-09-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110210320-A1 ANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME KCNJ2, KCNJ1, BRD4 HTR2C 3096/4885KDM4E 913/4885TP53 1074/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.