SCHEMBL19767385

SCHEMBL19767385

c1ccc2c(c1)sc1c(-c3ccc(-c4cnc5c(ccc6cc(-c7ccc(-c8cccc9c8sc8ccccc89)cc7)cnc65)c4)cc3)cccc12

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.53
KDM4E B2RXH2 2/20 0.41
LIMK1 P53667 4/20 0.39
PARP14 Q460N5 1/20 0.39
PRKDC P78527 4/20 0.38
MAPT P10636 1/20 0.38
PARP1 P09874 2/20 0.37
PIK3CD O00329 1/20 0.35
PIK3CB P42338 1/20 0.35
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
ADK P55263 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
ATM Q13315 1/20 0.35
GPR3 P46089 1/20 0.34
DNPH1 O43598 1/20 0.34

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
SCHEMBL15582304 0.93 ALOX5 (0.47) ALOX5KDM4ELIMK1PARP14PRKDC
SCHEMBL20042396 0.90 ALOX5 (0.44) ALOX5KDM4ELIMK1PARP14PRKDC
SCHEMBL21622606 0.86 ALOX5 (0.48) ALOX5KDM4ELIMK1PARP14PRKDC
SCHEMBL26561086 0.86 ALOX5 (0.48) ALOX5LIMK1PARP14PRKDCPIK3CD
SCHEMBL26558640 0.86 ALOX5 (0.48) ALOX5LIMK1PARP14PRKDCPIK3CD
SCHEMBL15582327 0.85 ALOX5 (0.44) ALOX5KDM4ELIMK1PARP14PRKDC
SCHEMBL26561051 0.83 ALOX5 (0.45) ALOX5PARP14PRKDCMAPTPIK3CD
SCHEMBL26549144 0.83 ALOX5 (0.45) ALOX5PRKDCPIK3CDCDK5CDK5R1
SCHEMBL26549423 0.83 ALOX5 (0.45) ALOX5PRKDCPIK3CDCDK5CDK5R1
SCHEMBL26569162 0.83 ALOX5 (0.45) ALOX5PARP14MAPTPARP1PIK3CD

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-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-04-12 US disclosed
US-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-04-12 US disclosed
US-9871206-B2 Compound, organic electroluminescence device material, organic electroluminescence device and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-01-16 US disclosed
US-9871206-B2 Compound, organic electroluminescence device material, organic electroluminescence device and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2018-01-16 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 (1 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-20180102484-A1 NEW COMPOUND, ORGANIC ELECTROLUMINESCENCE DEVICE MATERIAL, ORGANIC ELECTROLUMINESCENCE DEVICE AND ELECTRONIC DEVICE CBX8, MLX, HAX1 ALOX5 3743/4885KDM4E 1912/4885LIMK1 680/4885

“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.