SCHEMBL18565375

SCHEMBL18565375

Cn1c2ccccc2c2cc(-c3ccc4c(c3)sc3ccccc34)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.48
MAPT P10636 4/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
HPGD P15428 4/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 1/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 1/20 0.46
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
KIF11 P52732 1/20 0.42
NPC1 O15118 3/20 0.39
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PABPC1 P11940 1/20 0.39
NPY5R Q15761 1/20 0.38

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
SCHEMBL19001741 0.92 GPR3 (0.50) GPR3MAPTKDM4EALDH1A1HPGD
SCHEMBL18565366 0.92 RXRA (0.51) GPR3MAPTKDM4EALDH1A1HPGD
SCHEMBL26048114 0.89 GPR3 (0.41) GPR3MAPTKDM4EALDH1A1HPGD
SCHEMBL18565406 0.89 MAPT (0.40) GPR3MAPTKDM4EALDH1A1HPGD
SCHEMBL20022349 0.88 GPR3 (0.46) GPR3MAPTKDM4EALDH1A1HPGD
SCHEMBL13507015 0.87 GPR3 (0.44) GPR3MAPTKDM4EALDH1A1HPGD
SCHEMBL24667920 0.85 RXRA (0.46) GPR3MAPTKDM4EALDH1A1HPGD
SCHEMBL24667538 0.84 MEN1 (0.47) GPR3MAPTALDH1A1HPGDMEN1
SCHEMBL24667841 0.84 KDM4E (0.52) MAPTKDM4EALDH1A1HPGDHSD17B10
SCHEMBL24728701 0.84 RXRA (0.41) GPR3MAPTKDM4EALDH1A1HPGD

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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2019-05-14 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device EED, BMI1, CD99 GPR3 3915/4885MAPT 1057/4885KDM4E 225/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 GPR3 3915/4885MAPT 1057/4885KDM4E 225/4885

“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.