SCHEMBL19960243

SCHEMBL19960243

S=P(c1ccccc1)(c1ccccc1)c1cccc2nc3c4c5ccccc5ccc4c4cc5ccccc5cc4n3c12

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.32
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
CASP1 P29466 1/20 0.30
CYP2C19 P33261 1/20 0.30
CASP7 P55210 1/20 0.30
KMT2A Q03164 1/20 0.30
CAMKK1 Q8N5S9 1/20 0.30
CAMKK2 Q96RR4 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
SCHEMBL19960221 0.90 NPSR1 (0.36) NPSR1MEN1CYP1A2CYP2D6MAPT
SCHEMBL19960092 0.88 CAMKK1 (0.32) NPSR1ESR1ESR2MEN1CYP1A2
SCHEMBL19960250 0.86 KDM4E (0.38) NPSR1MEN1CYP1A2CYP2D6MAPT
SCHEMBL19960218 0.85 KDM4E (0.39) NPSR1MEN1CYP1A2CYP2D6MAPT
SCHEMBL19960247 0.85 KDM4E (0.36) NPSR1MEN1CYP1A2CYP2D6MAPT
SCHEMBL19960255 0.85 KDM4E (0.36) NPSR1MEN1CYP1A2CYP2D6MAPT
SCHEMBL19960251 0.85 NPSR1 (0.34) NPSR1
SCHEMBL19965947 0.83 KMT2A (0.41) NPSR1MEN1CYP1A2CYP2D6MAPT
SCHEMBL19960193 0.83 USP2 (0.30)
SCHEMBL19965979 0.83 KDM4E (0.34) NPSR1MEN1CYP1A2CYP2D6MAPT

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-10700289-B2 Heterocyclic compound and organic light emitting element comprising same LG CHEM, LTD. (KR) 2020-06-30 US disclosed
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-15 US disclosed
US-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-15 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-20180076395-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, PER2 NPSR1 3840/4885ESR1 20/4885ESR2 250/4885
US-10700289-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, PER2 NPSR1 3840/4885ESR1 20/4885ESR2 250/4885

“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.