SCHEMBL20174947

SCHEMBL20174947

c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c2ccc3c(c2)C2(c4ccccc4-3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3c2sc2ccccc32)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALK Q9UM73 1/20 0.32
PDK2 Q15119 1/20 0.32

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
SCHEMBL20199227 1.00 KDM4E (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20179369 1.00 KDM4E (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20175170 0.96 ALK (0.31) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20179324 0.95 PDK2 (0.34) ALKPDK2
SCHEMBL20199274 0.95 PDK2 (0.34) ALKPDK2
SCHEMBL20174916 0.95 PDK2 (0.34) ALKPDK2
SCHEMBL20199230 0.95 PTPN1 (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL20199223 0.94 PDK2 (0.33) ALKPDK2
SCHEMBL20199290 0.93 PDK2 (0.34) PDK2
SCHEMBL20199273 0.91 PTPN1 (0.33) ALKPDK2

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-11075342-B2 Spiro-type compound and organic light emitting diode comprising same LG CHEM, LTD. 2021-07-27 US disclosed
US-20180145261-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145261-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2018-05-24 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-11075342-B2 Spiro-type compound and organic light emitting diode comprising same CRY1, NR2E3, ALDH1A2 KDM4E 3539/4885MEN1 1032/4885LMNA 3627/4885
US-20180145261-A1 SPIRO-TYPE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME CRY1, NR2E3, ALDH1A2 KDM4E 3539/4885MEN1 1032/4885LMNA 3627/4885

“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.