SCHEMBL20176756

SCHEMBL20176756

c1ccc(-c2c3ccccc3c(-c3ccc(-c4cccc5c4oc4cc6ccccc6cc45)nc3)c3ccccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.38
ESR2 Q92731 6/20 0.38
ALOX5 P09917 3/20 0.36
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
GSK3B P49841 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
GRK5 P34947 1/20 0.33
ATR Q13535 1/20 0.33
NPC1 O15118 1/20 0.32
PRKDC P78527 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL26161088 0.99 ESR1 (0.37) ESR1ESR2ALOX5IDO1TDO2
SCHEMBL26160997 0.93 ALOX5 (0.41) ESR1ESR2ALOX5IDO1TDO2
SCHEMBL26161169 0.92 ALOX5 (0.41) ESR1ESR2ALOX5IDO1TDO2
SCHEMBL20176753 0.87 ALOX5 (0.46) ALOX5CDK1CCNB1GSK3BCDK5
SCHEMBL20176744 0.86 ESR1 (0.38) ESR1ESR2IDO1TDO2CDK1
SCHEMBL26161074 0.85 ALOX5 (0.45) ALOX5CDK1CCNB1GSK3BCDK5
SCHEMBL17931935 0.85 ALOX5 (0.46) ESR1ESR2ALOX5GSK3BPRKDC
SCHEMBL26161095 0.85 ESR1 (0.37) ESR1ESR2ALOX5IDO1TDO2
SCHEMBL17944421 0.84 ALOX5 (0.42) ESR1ESR2ALOX5PRKDCALDH1A1
SCHEMBL20176741 0.84 AHR (0.37) ATRNPC1ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11667622-B2 Organic light emitting compound and organic electroluminescence device using same SOLUS ADVANCED MATERIALS CO., LTD. (KR) 2023-06-06 US disclosed
US-11667622-B2 Organic light emitting compound and organic electroluminescence device using same SOLUS ADVANCED MATERIALS CO., LTD. (KR) 2023-06-06 US disclosed
WO-2018093231-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING SAME 주식회사 두산 2018-05-24 WO 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-11667622-B2 Organic light emitting compound and organic electroluminescence device using same OR10J3, ICMT, SLCO4C1 ESR1 310/4885ESR2 934/4885ALOX5 432/4885

“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.