SCHEMBL18708355

SCHEMBL18708355

c1ccc(-c2ccc(-n3c4ccccc4c4ccc(-c5ccc6c7ccccc7n(-c7ncc(-c8ccccc8)cn7)c6c5)cc43)nc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
CHRNA7 P36544 2/20 0.34
KCNH2 Q12809 2/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
LIMK1 P53667 1/20 0.34
NFKB1 P19838 2/20 0.33
NFKB2 Q00653 2/20 0.33
RELA Q04206 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.33
METAP2 P50579 1/20 0.32
EGLN1 Q9GZT9 2/20 0.32

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
SCHEMBL21320141 0.87 ATM (0.40) NPC1RAB9APOLBGAARXFP1
SCHEMBL16726774 0.85 L3MBTL1 (0.45) NPC1RAB9APOLBGAARXFP1
SCHEMBL23078816 0.84 NPC1 (0.37) NPC1RAB9APOLBGAARXFP1
SCHEMBL20060845 0.84 NPC1 (0.37) NPC1RAB9APOLBGAARXFP1
SCHEMBL17251537 0.84 NPC1 (0.37) NPC1RAB9APOLBGAARXFP1
SCHEMBL16089801 0.83 NPC1 (0.39) NPC1RAB9APOLBGAARXFP1
SCHEMBL18708352 0.83 KDM4E (0.42) NPC1RAB9APOLBGAARXFP1
SCHEMBL24490204 0.83 L3MBTL1 (0.46) NPC1RAB9APOLBGAARXFP1
SCHEMBL17251507 0.83 NPC1 (0.36) NPC1RAB9APOLBGAARXFP1
SCHEMBL24490206 0.83 L3MBTL1 (0.42) NPC1RAB9APOLBGAARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170098778-A1 COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE, ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2017-04-06 US disclosed
US-20170098778-A1 COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE, ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2017-04-06 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-20170098778-A1 COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE, ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE OXER1, OR10J3, OCIAD1 NPC1 3383/4885RAB9A 2578/4885POLB 3830/4885

“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.