SCHEMBL13556853

SCHEMBL13556853

c1ccc(-c2ccc3c(ccc4cc(-n5c6cccnc6c6c7ccccc7c7c(c8ccccc8c8c9ncccc9n(-c9ccc%10c(ccc%11cc(-c%12ccccc%12)ccc%11%10)c9)c87)c65)ccc43)c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.34
▸ LIMK1 P53667 1/20 0.33
▸ PLG P00747 1/20 0.32
▸ PLAU P00749 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ ESR2 Q92731 1/20 0.32
▸ TOP1 P11387 2/20 0.32
▸ MMP2 P08253 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ DHODH Q02127 1/20 0.31
▸ PDPK1 O15530 2/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAP3K8 P41279 1/20 0.31
▸ KHK P50053 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
SCHEMBL13556849 0.95 NR3C1 (0.36) NR3C1LIMK1PLGPLAUALDH1A1
SCHEMBL13556856 0.93 CYP17A1 (0.35) ALDH1A1KDM4ERAB9APDPK1MAPT
SCHEMBL13556858 0.87 MTOR (0.39) ALDH1A1TSHRESR1ESR2MMP2
SCHEMBL13556842 0.87 TSHR (0.38) ALDH1A1TSHRCYP2C19MMP2KDM4E
SCHEMBL13556832 0.84 ALDH1A1 (0.37) ALDH1A1TSHRCYP2C19MMP2KDM4E
SCHEMBL16547029 0.82 ESR1 (0.35) NR3C1ALDH1A1TSHRCYP2C19ESR1
SCHEMBL13556859 0.82 ALDH1A1 (0.34) ALDH1A1TSHRCYP2C19TOP1MMP2
SCHEMBL13556850 0.81 ADORA3 (0.33) ALDH1A1KDM4ERAB9AL3MBTL1MAPT
SCHEMBL13556854 0.81 ALDH1A1 (0.36) ALDH1A1TSHRCYP2C19MMP2KDM4E
SCHEMBL15335472 0.80 NR3C1 (0.35) NR3C1LIMK1TOP1

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-8889270-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-18 — — US disclosed
US-8889270-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2014-11-18 — — US disclosed
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2012-10-25 — — US disclosed
US-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2012-10-25 — — 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-20120267613-A1 ORGANIC LIGHT-EMITTING DEVICE CRY1, CYP1A1, CRY2 NR3C1 993/4885LIMK1 419/4885PLG 4605/4885

“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.

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