SCHEMBL19686044

SCHEMBL19686044

Cc1cn(-c2ccccc2)c(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNKS2 Q9H2K2 1/20 0.39
BRD4 O60885 2/20 0.37
ESR1 P03372 1/20 0.37
ESRRA P11474 1/20 0.37
ESR2 Q92731 1/20 0.37
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
APP P05067 1/20 0.36
COMT P21964 4/20 0.35
MAOB P27338 1/20 0.35
ACVR1 Q04771 2/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
BLM P54132 1/20 0.34
HSD17B10 Q99714 1/20 0.34
FEN1 P39748 1/20 0.34
SCN2B O60939 1/20 0.33
SCN1A P35498 1/20 0.33
SCN1B Q07699 1/20 0.33

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
SCHEMBL19686145 0.95 KDM4E (0.40) TNKS2BRD4ESR1ESRRAESR2
SCHEMBL19686045 0.91 KDM4E (0.39) ESR1ESRRAESR2KDM4EALDH1A1
SCHEMBL19686144 0.85 KDM4E (0.42) ESR1ESRRAESR2KDM4EALDH1A1
SCHEMBL19685725 0.84 BRD4 (0.50) TNKS2BRD4KDM4EALDH1A1MAOB
SCHEMBL19685830 0.81 APP (0.34) ESR1ESRRAESR2KDM4EALDH1A1
SCHEMBL19685923 0.81 IRAK1 (0.42) TNKS2APPCOMTMAOBSCN2B
SCHEMBL19685978 0.81 SCN2B (0.40) TNKS2APPCOMTSCN2BSCN1A
SCHEMBL19686043 0.79 ESR1 (0.40) TNKS2BRD4ESR1ESRRAESR2
SCHEMBL19685722 0.79 BRD4 (0.53) TNKS2BRD4
SCHEMBL19686344 0.76 ESR1 (0.36) ESR1ESRRAESR2KDM4EALDH1A1

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-10714693-B2 Polycyclic compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-07-14 US disclosed
US-20170352817-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2017-12-07 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 (2 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-10714693-B2 Polycyclic compound and organic electroluminescence device including the same CYC1, CCNA1, CYCS TNKS2 3059/4885BRD4 740/4885ESR1 503/4885
US-20170352817-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME CYC1, CCNA1, CYCS TNKS2 3059/4885BRD4 740/4885ESR1 503/4885

“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.