SCHEMBL19686040

SCHEMBL19686040

Cc1cn(-c2ccccc2)c(=O)c2ccc(N3c4ccccc4C(c4ccccc4)(c4ccccc4)c4ccccc43)cc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.36
ESRRA P11474 2/20 0.36
ESR2 Q92731 2/20 0.36
KDM4E B2RXH2 6/20 0.36
LMNA P02545 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.32
DHODH Q02127 2/20 0.32
SCN2B O60939 1/20 0.31
SCN1A P35498 1/20 0.31
SCN1B Q07699 1/20 0.31
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31
CYP1A2 P05177 1/20 0.31
BLM P54132 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
STAT1 P42224 1/20 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
SCHEMBL19685874 0.95 ESR1 (0.34) ESR1ESRRAESR2KDM4ELMNA
SCHEMBL19685883 0.90 PKM (0.37) ESR1ESRRAESR2KDM4ELMNA
SCHEMBL19686037 0.90 ESR1 (0.38) ESR1ESRRAESR2KDM4ELMNA
SCHEMBL19685857 0.87 BRD4 (0.37) STAT1ITGB2ICAM1ITGALCNR1
SCHEMBL19685934 0.87 ESR1 (0.34) ESR1ESRRAESR2KDM4ELMNA
SCHEMBL19686148 0.87 ESR1 (0.34) ESR1ESRRAESR2KDM4ELMNA
SCHEMBL19685994 0.85 ESR1 (0.36) ESR1ESRRAESR2KDM4ELMNA
SCHEMBL19685823 0.83 MAPK8 (0.33) KDM4ELMNAALDH1A1HPGDSCN2B
SCHEMBL19685869 0.83 SCN2B (0.36) KDM4ELMNAALDH1A1HPGDSCN2B
SCHEMBL19686134 0.83 ESR1 (0.32) ESR1ESRRAESR2KDM4ELMNA

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 ESR1 503/4885ESRRA 1108/4885ESR2 808/4885
US-20170352817-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME CYC1, CCNA1, CYCS ESR1 503/4885ESRRA 1108/4885ESR2 808/4885

“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.