SCHEMBL22157239

SCHEMBL22157239

N#Cc1c(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)ccc(-c2c(F)c(F)c(F)c(F)c2F)c1-n1c2ccc(-c3ccccc3)cc2c2cc(-c3ccccc3)ccc21

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
PDE9A O76083 1/20 0.31
PDE1C Q14123 1/20 0.31
SQOR Q9Y6N5 1/20 0.31
GRIA2 P42262 1/20 0.30
GRIA4 P48058 1/20 0.30

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
SCHEMBL22156589 0.97 PDE9A (0.33) ADORA2AADORA1PDE9APDE1CSQOR
SCHEMBL22157242 0.91 SMN1; SMN2 (0.33) ADORA2AADORA1SMN1; SMN2HIF1ACYP11B1
SCHEMBL22158542 0.91 ADORA1 (0.33) ADORA2AADORA1SMN1; SMN2HIF1ASQOR
SCHEMBL22156588 0.90 PDE9A (0.33) ADORA2AADORA1SMN1; SMN2HIF1APDE9A
SCHEMBL22157320 0.90 SMN1; SMN2 (0.33) ADORA2AADORA1SMN1; SMN2HIF1ACYP11B1
SCHEMBL22157335 0.89 ADORA2A (0.33) ADORA2AADORA1SQOR
SCHEMBL22156665 0.89 ADORA1 (0.36) ADORA2AADORA1SMN1; SMN2HIF1ACYP11B1
SCHEMBL22157178 0.88 SQOR (0.33) ADORA2AADORA1SMN1; SMN2PDE9APDE1C
SCHEMBL22158551 0.87 NRP1 (0.32) ADORA2AADORA1SMN1; SMN2HIF1ACYP11B1
SCHEMBL22155955 0.86 SSTR2 (0.36) ADORA2AADORA1SMN1; SMN2HIF1ACYP11B1

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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 ADORA2A 4520/4885ADORA1 4534/4885SMN1; SMN2 4592/4885

“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.