SCHEMBL20199560

SCHEMBL20199560

c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c(c43)-c3ccccc3C53c4ccccc4C4(c5ccccc5-c5ccccc54)c4ccccc43)n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2C19 P33261 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
NPSR1 Q6W5P4 2/20 0.32
AGTR1 P30556 2/20 0.32
CYP3A4 P08684 1/20 0.32
GAA P10253 1/20 0.32
DUSP3 P51452 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPK10 P53779 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.30
MAPK1 P28482 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL15840155 0.99 MAPT (0.33) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL17279363 0.98 MAPT (0.33) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL17279358 0.97 MAPT (0.32) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL25121526 0.97 MAPT (0.32) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL15832285 0.93 DUSP3 (0.32) DUSP3
SCHEMBL19700888 0.93 MAPT (0.32) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL17381191 0.91 THRB (0.31)
SCHEMBL15840266 0.89 PDK2 (0.32) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL15840267 0.89 PDK2 (0.32) MAPTCYP1A2CYP2C9CYP2C19SMN1; SMN2
SCHEMBL17381214 0.89 THRB (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11001752-B2 Double spiro organic compound and organic electronic element comprising same LG CHEM, LTD. (KR) 2021-05-11 US disclosed
US-20180148640-A1 DOUBLE SPIRO ORGANIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-31 US disclosed
US-20180148640-A1 DOUBLE SPIRO ORGANIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-31 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 (2 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-11001752-B2 Double spiro organic compound and organic electronic element comprising same DCX, TERT, TELO2 MAPT 1276/4885CYP1A2 1649/4885CYP2C9 1044/4885
US-20180148640-A1 DOUBLE SPIRO ORGANIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT COMPRISING SAME DCX, TERT, TELO2 MAPT 1276/4885CYP1A2 1649/4885CYP2C9 1044/4885

“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.