SCHEMBL22158275

SCHEMBL22158275

N#Cc1cc(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-c2cc(F)cc(F)c2)cc1-n1c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR2 P30874 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
HIF1A Q16665 1/20 0.34
CYP11B1 P15538 2/20 0.34
CYP11B2 P19099 2/20 0.34
SQOR Q9Y6N5 1/20 0.34
ALDH1A1 P00352 3/20 0.33
LMNA P02545 3/20 0.33
CYP1A2 P05177 3/20 0.33
ABCG2 Q9UNQ0 2/20 0.33
MEN1 O00255 2/20 0.33
CYP2C9 P11712 2/20 0.33
TSHR P16473 2/20 0.33
CYP2C19 P33261 2/20 0.33
KMT2A Q03164 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
NR3C1 P04150 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
SCHEMBL22158273 0.98 SSTR2 (0.35) SSTR2SMN1; SMN2HIF1ACYP11B1CYP11B2
SCHEMBL22156817 0.92 SSTR2 (0.35) SSTR2SMN1; SMN2CYP11B1CYP11B2SQOR
SCHEMBL22158274 0.92 SSTR2 (0.36) SSTR2CYP11B1CYP11B2SQORALDH1A1
SCHEMBL22156563 0.91 CYP11B1 (0.37) SSTR2SMN1; SMN2HIF1ACYP11B1CYP11B2
SCHEMBL22156564 0.89 CYP11B1 (0.36) SSTR2SMN1; SMN2HIF1ACYP11B1CYP11B2
SCHEMBL23299783 0.88 GRM5 (0.35) SSTR2CYP11B1CYP11B2SQORCYP2C9
SCHEMBL22158277 0.87 SSTR2 (0.35) SSTR2CYP11B1CYP11B2SQORCYP2C9
SCHEMBL22156797 0.87 ALDH1A1 (0.35) SMN1; SMN2HIF1ACYP11B1CYP11B2SQOR
SCHEMBL19919654 0.87 ABCG2 (0.39) SMN1; SMN2HIF1AALDH1A1LMNACYP1A2
SCHEMBL19917799 0.86 ABCG2 (0.34) SMN1; SMN2HIF1ACYP11B1CYP11B2ALDH1A1

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 SSTR2 911/4885SMN1; SMN2 4592/4885HIF1A 2459/4885

“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.