SCHEMBL9890491

SCHEMBL9890491

c1ccc2c(c1)c1ccccc1n2-c1ccc2sc3cc4sc5ccc(-n6c7ccccc7c7ccccc76)cc5c4cc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
ATM Q13315 1/20 0.47
GPR3 P46089 2/20 0.39
MAPT P10636 5/20 0.37
ALDH1A1 P00352 4/20 0.37
RAB9A P51151 2/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
RXFP1 Q9HBX9 1/20 0.32
CYP1A2 P05177 2/20 0.32
HSD17B10 Q99714 1/20 0.32
PTPN1 P18031 2/20 0.31
CYP2C19 P33261 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
NPC1 O15118 1/20 0.31
HDAC4 P56524 1/20 0.31

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
SCHEMBL9890233 0.95 KDM4E (0.48) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL29397828 0.95 KDM4E (0.52) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL29398379 0.95 KDM4E (0.52) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL126273 0.95 KDM4E (0.52) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL15462323 0.91 GPR3 (0.50) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL26049262 0.91 KDM4E (0.48) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL21671373 0.91 KDM4E (0.48) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL14867973 0.91 KDM4E (0.48) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL16283005 0.91 GPR3 (0.42) KDM4EL3MBTL1ATMGPR3MAPT
SCHEMBL16409636 0.90 KDM4E (0.47) KDM4EL3MBTL1ATMGPR3MAPT

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 990/4885L3MBTL1 709/4885ATM 3103/4885
US-20100012931-A1 POLYCYCLIC COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICE EMPLOYING THE SAME KCNC1, EED, BMI1 KDM4E 990/4885L3MBTL1 709/4885ATM 3103/4885

“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.