SCHEMBL9890403

SCHEMBL9890403

Cc1ccc2oc3ccc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c3c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 4/20 0.39
CYP3A4 P08684 3/20 0.39
MAPK1 P28482 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 6/20 0.37
HTT P42858 1/20 0.37
PPARG P37231 3/20 0.37
RXFP1 Q9HBX9 3/20 0.37
NR2E3 Q9Y5X4 3/20 0.37
NCOR2 Q9Y618 3/20 0.37
LMNA P02545 2/20 0.37
NPSR1 Q6W5P4 2/20 0.36
HSD17B10 Q99714 3/20 0.35
POLB P06746 3/20 0.35
TSHR P16473 1/20 0.35
BRCA1 P38398 1/20 0.35
L3MBTL1 Q9Y468 3/20 0.35

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
SCHEMBL9890142 0.92 ALDH1A1 (0.40) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL9890384 0.92 KDM4E (0.41) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL9890525 0.90 KDM4E (0.41) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL10144804 0.89 KDM4E (0.43) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL9890432 0.87 KDM4E (0.37) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL17807295 0.87 KDM4E (0.37) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL17636095 0.87 KDM4E (0.41) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL20115828 0.87 KDM4E (0.41) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL9890083 0.87 KDM4E (0.41) KDM4EMEN1KMT2AMAPTCYP3A4
SCHEMBL17850761 0.87 KDM4E (0.41) KDM4EMEN1KMT2AMAPTCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-01-24 US disclosed
US-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2013-01-24 US disclosed
US-8318323-B2 Polycyclic compounds and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2012-11-27 US disclosed
US-8318323-B2 Polycyclic compounds and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2012-11-27 US disclosed
US-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed
US-20120138915-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-07 US disclosed
US-20100012931-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2010-01-21 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-20130020563-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME KCNC1, EED, BMI1 KDM4E 990/4885MEN1 1530/4885KMT2A 842/4885
US-20100012931-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME KCNC1, EED, BMI1 KDM4E 990/4885MEN1 1530/4885KMT2A 842/4885

“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.