SCHEMBL17640602

SCHEMBL17640602

c1ccc(-c2ccc(-c3ccc(-c4noc(-c5ccccc5)n4)cc3)cc2)cc1

nearest known ligand 0.91

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 3/20 0.91
SMN1; SMN2 Q16637 11/20 0.82
RAB9A P51151 9/20 0.82
NPC1 O15118 7/20 0.82
MAPT P10636 5/20 0.82
HSD17B10 Q99714 4/20 0.82
NFKB1 P19838 4/20 0.82
NFKB2 Q00653 4/20 0.82
RELA Q04206 4/20 0.82
TP53 P04637 6/20 0.71
KDM4E B2RXH2 3/20 0.71
ALDH1A1 P00352 3/20 0.71
HPGD P15428 2/20 0.71
S1PR1 P21453 1/20 0.71
MEN1 O00255 3/20 0.70
KMT2A Q03164 3/20 0.70
CYP1A2 P05177 1/20 0.70
CA2 P00918 2/20 0.67
CA9 Q16790 2/20 0.67
CA12 O43570 1/20 0.67

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
SCHEMBL321073 1.00 NR1H4 (0.91) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL1473020 0.96 NR1H4 (1.00) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL2810636 0.90 NR1H4 (1.00) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL12083885 0.89 NR1H4 (0.72) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL10495613 0.89 NR1H4 (0.77) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL3059321 0.88 NR1H4 (0.78) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL14081496 0.88 NPC1 (1.00) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL16592554 0.88 NR1H4 (0.78) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL2062609 0.88 NR1H4 (0.78) NR1H4SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL3061782 0.88 NR1H4 (0.78) NR1H4SMN1; SMN2RAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10333078-B2 Fluorescent organic light emitting elements having high efficiency UDC IRELAND LIMITED (IE) 2019-06-25 US disclosed
US-20170309828-A1 Fluorescent Organic Light Emitting Elements Having High Efficiency BASF SE (DE) 2017-10-26 US disclosed
US-20170309828-A1 Fluorescent Organic Light Emitting Elements Having High Efficiency BASF SE (DE) 2017-10-26 US disclosed
WO-2016046350-A1 FLUORESCENT ORGANIC LIGHT EMITTING ELEMENTS HAVING HIGH EFFICIENCY BASF SE (DE) 2016-03-31 WO 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-10333078-B2 Fluorescent organic light emitting elements having high efficiency NR2E3, CRY1, ALDH1A2 NR1H4 3168/4885SMN1; SMN2 3296/4885RAB9A 4709/4885
US-20170309828-A1 Fluorescent Organic Light Emitting Elements Having High Efficiency NR2E3, CRY1, ALDH1A2 NR1H4 3168/4885SMN1; SMN2 3296/4885RAB9A 4709/4885

“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.