SCHEMBL18907357

SCHEMBL18907357

Brc1cc2c(-c3ccccc3)nc3c4ccccc4ccc3c2c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.38
CYP1A1 P04798 5/20 0.38
CYP1B1 Q16678 4/20 0.38
MAOA P21397 2/20 0.38
MAPT P10636 5/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CYP2D6 P10635 2/20 0.35
ADORA2A P29274 1/20 0.34
NUDT1 P36639 1/20 0.34
ALDH1A1 P00352 4/20 0.33
TP53 P04637 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
PRNP P04156 2/20 0.33
ALOX15 P16050 1/20 0.33
FYN P06241 2/20 0.33
AHR P35869 2/20 0.33
ERBB2 P04626 1/20 0.33
ACHE P22303 1/20 0.33
HPRT1 P00492 1/20 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
SCHEMBL18907231 0.83 NUDT1 (0.41) CYP1A2CYP1A1CYP1B1MAOAMAPT
SCHEMBL18907200 0.82 MAOA (0.40) MAOAMAPTL3MBTL1ADORA2ANUDT1
SCHEMBL17035120 0.80 NUDT1 (0.46) CYP1A2MAPTL3MBTL1ADORA2ANUDT1
SCHEMBL18907362 0.80 MAPT (0.43) MAPTL3MBTL1ADORA2ANUDT1ALDH1A1
SCHEMBL18907209 0.80 MAOA (0.38) MAOAMAPTL3MBTL1ADORA2ANUDT1
SCHEMBL18907243 0.79 ALDH1A1 (0.36) CYP1A2MAOAMAPTL3MBTL1CYP2D6
SCHEMBL18907206 0.79 MAOA (0.37) CYP1A2MAOAMAPTL3MBTL1CYP2D6
SCHEMBL18907359 0.78 ESR1 (0.46) CYP1A2MAPTL3MBTL1ADORA2ANUDT1
SCHEMBL18842650 0.77 IDO1 (0.41) CYP1A2CYP1A1CYP1B1MAOAMAPT
SCHEMBL18907240 0.76 MAPT (0.43) CYP1A2CYP1A1CYP1B1MAOAMAPT

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-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 US disclosed
US-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 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-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, OCIAD1, CCNT1 CYP1A2 421/4885CYP1A1 92/4885CYP1B1 191/4885

“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.