SCHEMBL18907200

SCHEMBL18907200

c1ccc(-c2nc3ccccc3c3c2cc(-c2cc4c(-c5ccccc5)nc5c6ccccc6ccc5c4c4ccccc24)c2ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.40
NUDT1 P36639 3/20 0.40
ADORA2A P29274 1/20 0.40
PDE10A Q9Y233 3/20 0.39
MAPT P10636 4/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ATM Q13315 1/20 0.35
DHODH Q02127 1/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
PKM P14618 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35

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
SCHEMBL18907209 0.95 MAOA (0.38) MAOANUDT1ADORA2APDE10AMAPT
SCHEMBL18907206 0.93 MAOA (0.37) MAOANUDT1ADORA2APDE10AMAPT
SCHEMBL18346946 0.86 ESR1 (0.40) MAOANUDT1ADORA2APDE10AMAPT
SCHEMBL18907232 0.83 AKT1 (0.37) MAOANUDT1ADORA2APDE10AMAPT
SCHEMBL18907243 0.83 ALDH1A1 (0.36) MAOAMAPTMEN1KMT2AKDM4E
SCHEMBL18907216 0.82 MAOA (0.36) MAOANUDT1ADORA2APDE10AMAPT
SCHEMBL18907231 0.82 NUDT1 (0.41) MAOANUDT1ADORA2AMAPTMEN1
SCHEMBL18907357 0.82 CYP1A2 (0.38) MAOANUDT1ADORA2AMAPTMEN1
SCHEMBL17035022 0.81 NUDT1 (0.38) NUDT1ADORA2APDE10AMAPTMEN1
SCHEMBL17034863 0.80 NUDT1 (0.50) NUDT1ADORA2APDE10AMAPTMEN1

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 MAOA 1025/4885NUDT1 1449/4885ADORA2A 4465/4885

“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.