SCHEMBL22158551

SCHEMBL22158551

N#Cc1c(-n2c3ccccc3c3cc(-c4ccccc4)ccc32)ccc(-c2c(F)cccc2F)c1-n1c2ccccc2c2cc(-c3ccccc3)ccc21

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NRP1 O14786 2/20 0.32
TSPO P30536 1/20 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 0.31
GRIA4 P48058 1/20 0.31
HTR3A P46098 1/20 0.30
ADORA2A P29274 2/20 0.30
ADORA1 P30542 2/20 0.30
PARP1 P09874 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
SCHEMBL22157320 0.97 SMN1; SMN2 (0.33) NRP1SMN1; SMN2HIF1ACYP11B1CYP11B2
SCHEMBL22158560 0.94 SMN1; SMN2 (0.33) NRP1SMN1; SMN2HIF1ACYP11B1CYP11B2
SCHEMBL22157288 0.91 SQOR (0.32) NRP1SMN1; SMN2HIF1ASQORADORA2A
SCHEMBL22156589 0.91 PDE9A (0.33) TSPOPDE9APDE1CSQORHTR3A
SCHEMBL22157321 0.90 SMN1; SMN2 (0.35) SMN1; SMN2HIF1ACYP11B1CYP11B2SQOR
SCHEMBL22157344 0.90 SQOR (0.36) CYP11B1CYP11B2SQORADORA2AADORA1
SCHEMBL22158545 0.90 ALOX5AP (0.34) CYP11B1CYP11B2SQORADORA2AADORA1
SCHEMBL22158556 0.90 SQOR (0.32) SQORADORA2AADORA1
SCHEMBL22156548 0.88 CLK4 (0.33) SQOR
SCHEMBL22157239 0.87 ADORA2A (0.32) SMN1; SMN2HIF1ACYP11B1CYP11B2PDE9A

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 NRP1 3132/4885TSPO 499/4885SMN1; 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.