SCHEMBL19397495

SCHEMBL19397495

c1ccc(-c2ccc(-c3cc(-c4cccc(-c5ccc6ccccc6c5)c4)nc(-c4cccc5c4oc4ccccc45)n3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.46
CYP1B1 Q16678 1/20 0.46
ALOX5 P09917 2/20 0.44
PIM1 P11309 2/20 0.39
CYP1A2 P05177 3/20 0.39
CTRC Q99895 1/20 0.38
PLA2G2A P14555 1/20 0.37
PLA2G4A P47712 1/20 0.37
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
TP53 P04637 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HSD17B10 Q99714 2/20 0.36
GGPS1 O95749 1/20 0.36
ACACA Q13085 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
MAPT P10636 3/20 0.36
PRKDC P78527 1/20 0.36

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
SCHEMBL22104545 0.98 ALOX5 (0.46) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL19397386 0.98 ALOX5 (0.46) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL19397604 0.97 ALOX5 (0.43) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL19397493 0.94 ALOX5 (0.49) ALOX5PIM1PLA2G2APLA2G4AALDH1A1
SCHEMBL22308653 0.93 ALOX5 (0.43) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL24687348 0.93 ALOX5 (0.47) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL15501576 0.93 ALOX5 (0.47) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL17899191 0.93 ALOX5 (0.47) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL15501754 0.93 ALOX5 (0.47) CYP1A1CYP1B1ALOX5PIM1CYP1A2
SCHEMBL19397382 0.93 ALOX5 (0.50) ALOX5PIM1PLA2G2APLA2G4AALDH1A1

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-10580995-B2 Compounds for organic electroluminescent components and organic electroluminescent devices using the same E-RAY OPTOELECTRONICS TECHNOLOGY CO., LTD. (TW) 2020-03-03 US disclosed
US-20170279054-A1 COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT COMPONENTS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME E-RAY OPTOELECTRONICS TECHNOLOGY CO., LTD. (TW) 2017-09-28 US disclosed
US-20170279054-A1 COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT COMPONENTS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME E-RAY OPTOELECTRONICS TECHNOLOGY CO., LTD. (TW) 2017-09-28 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-10580995-B2 Compounds for organic electroluminescent components and organic electroluminescent devices using the same C1S, AOC2, L1CAM CYP1A1 83/4885CYP1B1 307/4885ALOX5 2060/4885
US-20170279054-A1 COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT COMPONENTS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME L1CAM, C1S, F10 CYP1A1 241/4885CYP1B1 659/4885ALOX5 2055/4885

“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.