SCHEMBL21156636

SCHEMBL21156636

c1ccc(-c2cc(-c3ccccc3)cc(-c3nc(-c4cc(-c5ccccc5)cc(-c5ccccc5)c4)nc(-c4ccccc4-c4cc(-c5ccccc5)cc5c6cc(-c7ccccc7)cc(-c7ccccc7-c7nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)nc(-c8cc(-c9ccccc9)cc(-c9ccccc9)c8)n7)c6n(-c6ccccc6)c45)n3)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
ABCG2 Q9UNQ0 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
ALOX15 P16050 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
AVPR1A P37288 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
THRB P10828 1/20 0.33
XBP1 P17861 1/20 0.33
PTBP1 P26599 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 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
SCHEMBL21156631 0.95 TSHR (0.39) TSHRABCG2ADORA3ALOX15ADORA2A
SCHEMBL21156632 0.94 ABCG2 (0.36) TSHRABCG2ADORA3ALOX15ADORA2A
SCHEMBL21157179 0.90 MEN1 (0.36) TSHRABCG2ADORA3ALOX15ADORA2A
SCHEMBL21157178 0.89 TSHR (0.39) TSHRAVPR1AL3MBTL1LMNAMEN1
SCHEMBL21157829 0.88 AVPR1A (0.40) TSHRABCG2ADORA3ALOX15ADORA2A
SCHEMBL21157826 0.88 TSHR (0.36) TSHRAVPR1AKMT2ANPC1RAB9A
SCHEMBL21156635 0.88 AVPR1A (0.40) TSHRABCG2ADORA3ALOX15ADORA2A
SCHEMBL21156633 0.88 AVPR1A (0.37) TSHRABCG2AVPR1AL3MBTL1LMNA
SCHEMBL21157092 0.88 AVPR1A (0.37) TSHRABCG2AVPR1AL3MBTL1LMNA
SCHEMBL21156634 0.87 AVPR1A (0.36) TSHRADORA3ALOX15ADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-07-11 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-20190214577-A1 THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, POLYMER, MIXTURE, FORMULATION, AND ORGANIC ELECTRONIC DEVICE TEAD2, TEAD3, TEAD1 TSHR 3560/4885ABCG2 283/4885ADORA3 2835/4885

“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.