SCHEMBL19167643

SCHEMBL19167643

c1ccc(-c2nc(-c3ccc(-c4ccncc4)cc3)cc(-c3ccc4ccc5cccc6ccc3c4c56)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
ALDH1A1 P00352 5/20 0.48
HPGD P15428 4/20 0.48
KDM4E B2RXH2 4/20 0.48
MAPK1 P28482 1/20 0.44
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
NTSR1 P30989 1/20 0.43
LMNA P02545 3/20 0.42
GLA P06280 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
RECQL P46063 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
DHODH Q02127 1/20 0.40
NPC1 O15118 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL19168116 1.00 MAPT (0.48) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19166989 1.00 MAPT (0.48) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19166320 0.95 ALDH1A1 (0.46) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19168422 0.95 MAPT (0.51) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19168037 0.95 MAPT (0.51) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19167344 0.95 MAPT (0.51) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19166937 0.95 MAPT (0.51) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19168157 0.95 MAPT (0.51) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19168142 0.95 MAPT (0.51) MAPTALDH1A1HPGDKDM4EMAPK1
SCHEMBL19167352 0.94 MAPT (0.44) MAPTALDH1A1HPGDKDM4EMAPK1

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-10797244-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2020-10-06 US disclosed
US-20170213982-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-07-27 US disclosed
US-20170213982-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-07-27 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-10797244-B2 Compound, material for organic electroluminescent element, organic electroluminescent element, and electronic device RER1, RBM12, H1-2 MAPT 3267/4885ALDH1A1 1176/4885HPGD 3711/4885
US-20170213982-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE RER1, RBM12, H1-2 MAPT 3267/4885ALDH1A1 1176/4885HPGD 3711/4885

“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.