SCHEMBL21707841

SCHEMBL21707841

c1ccc(-c2ccc(N(c3ccc4oc5ccccc5c4c3)c3cc4c(cc3-c3ccccc3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.31
OPRK1 P41145 1/20 0.31
PLA2G2A P14555 1/20 0.30
PLA2G4A P47712 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
SCHEMBL21707699 0.94 KDM4E (0.32) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL21707561 0.92 KDM4E (0.34) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL21707565 0.92 KDM4E (0.34) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL26999828 0.91 PLA2G2A (0.33) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL25517032 0.91 ABCG2 (0.33) KDM4EMAPTKMT2AALDH1A1HPGD
SCHEMBL21392614 0.91 KDM4E (0.33) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL26999829 0.91 PLA2G2A (0.32) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL18212023 0.90 PLA2G2A (0.32) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL21392658 0.90 KDM4E (0.33) KDM4EMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL20441819 0.90 AHR (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200048232-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-13 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-20200048232-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, CYP1A1 KDM4E 3435/4885MEN1 268/4885MAPT 1909/4885

“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.